1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine

C151H173N79O12S12 — CID 158177763

IUPAC1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine
SMILESC1=NN=C(CN(CC2=NN=CC2)CC2=NN=CC2)C1.Cn1ccc(CN(Cc2ccn[nH]2)Cc2ccn[nH]2)n1.Cn1ccnc1CN(Cc1nccn1C)Cc1nccn1C.Cn1cnc(CN(Cc2cn(C)cn2)Cc2cn(C)cn2)c1.c1cc(CN(Cc2ccon2)Cc2ccon2)no1.c1cc(CN(Cc2ccsn2)Cc2ccsn2)ns1.c1nc(CN(Cc2cocn2)Cc2cocn2)co1.c1nc(CN(Cc2cscn2)Cc2cscn2)cs1.c1ncc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)[nH]1.c1nnc(CN(Cc2nnco2)Cc2nnco2)o1.c1nnc(CN(Cc2nncs2)Cc2nncs2)s1.c1nonc1CN(Cc1cnon1)Cc1cnon1.c1nsnc1CN(Cc1cnsn1)Cc1cnsn1
InChIInChI=1S/2C15H21N7.C13H17N7.2C12H15N7.2C12H12N4O3.2C12H12N4S3.2C9H9N7O3.2C9H9N7S3/c1-19-4-13(16-10-19)7-22(8-14-5-20(2)11-17-14)9-15-6-21(3)12-18-15;1-19-7-4-16-13(19)10-22(11-14-17-5-8-20(14)2)12-15-18-6-9-21(15)3;1-19-7-4-13(18-19)10-20(8-11-2-5-14-16-11)9-12-3-6-15-17-12;1-10(16-7-13-1)4-19(5-11-2-14-8-17-11)6-12-3-15-9-18-12;1-4-13-16-10(1)7-19(8-11-2-5-14-17-11)9-12-3-6-15-18-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9/h4-6,10-12H,7-9H2,1-3H3;4-9H,10-12H2,1-3H3;2-7H,8-10H2,1H3,(H,14,16)(H,15,17);1-3,7-9H,4-6H2,(H,13,16)(H,14,17)(H,15,18);4-6H,1-3,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-6H,1-3H2;1-3H,4-6H2;4-6H,1-3H2;1-3H,4-6H2
InChIKeyFYEZQPWKWKOBTC-UHFFFAOYSA-N
MW3671.39 g/mol
LogP18.27
Rot. Bonds78

About 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine

1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine (PubChem CID 158177763) has the molecular formula C151H173N79O12S12 and a molecular weight of 3671.39 g/mol. Its IUPAC name is 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine
PubChem CID158177763
Molecular FormulaC151H173N79O12S12
Molecular Weight3671.39 g/mol
Exact Mass3668.20
IUPAC Name1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine
SMILESC1=NN=C(CN(CC2=NN=CC2)CC2=NN=CC2)C1.Cn1ccc(CN(Cc2ccn[nH]2)Cc2ccn[nH]2)n1.Cn1ccnc1CN(Cc1nccn1C)Cc1nccn1C.Cn1cnc(CN(Cc2cn(C)cn2)Cc2cn(C)cn2)c1.c1cc(CN(Cc2ccon2)Cc2ccon2)no1.c1cc(CN(Cc2ccsn2)Cc2ccsn2)ns1.c1nc(CN(Cc2cocn2)Cc2cocn2)co1.c1nc(CN(Cc2cscn2)Cc2cscn2)cs1.c1ncc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)[nH]1.c1nnc(CN(Cc2nnco2)Cc2nnco2)o1.c1nnc(CN(Cc2nncs2)Cc2nncs2)s1.c1nonc1CN(Cc1cnon1)Cc1cnon1.c1nsnc1CN(Cc1cnsn1)Cc1cnsn1
InChIInChI=1S/2C15H21N7.C13H17N7.2C12H15N7.2C12H12N4O3.2C12H12N4S3.2C9H9N7O3.2C9H9N7S3/c1-19-4-13(16-10-19)7-22(8-14-5-20(2)11-17-14)9-15-6-21(3)12-18-15;1-19-7-4-16-13(19)10-22(11-14-17-5-8-20(14)2)12-15-18-6-9-21(15)3;1-19-7-4-13(18-19)10-20(8-11-2-5-14-16-11)9-12-3-6-15-17-12;1-10(16-7-13-1)4-19(5-11-2-14-8-17-11)6-12-3-15-9-18-12;1-4-13-16-10(1)7-19(8-11-2-5-14-17-11)9-12-3-6-15-18-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9/h4-6,10-12H,7-9H2,1-3H3;4-9H,10-12H2,1-3H3;2-7H,8-10H2,1H3,(H,14,16)(H,15,17);1-3,7-9H,4-6H2,(H,13,16)(H,14,17)(H,15,18);4-6H,1-3,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-6H,1-3H2;1-3H,4-6H2;4-6H,1-3H2;1-3H,4-6H2
InChIKeyFYEZQPWKWKOBTC-UHFFFAOYSA-N
XLogP18.27
TPSA1006.14 Ų
H-Bond Donors5
H-Bond Acceptors98
Rotatable Bonds78
Heavy Atoms254
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003671.39
LogP ≤ 518.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1098

Analyze 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine with MolForge

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Launch Full Analysis

Related Compounds

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2-[1-(furan-2-yl)-5-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-1-(1H-pyrazol-5-yl)-1-(1H-pyrrol-2-yl)-1-thiophen-2-yl-1,3-thiazol-4-yl]-1,3-oxazole
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2-[2-(1H-imidazol-2-yl)-1-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-1-(1,2-thiazol-3-yl)-1-(1,3-thiazol-2-yl)-1,3,4-thiadiazol-1-yl]-1,3-oxazole
CID 141099587
3,5-dimethyl-1,2,4-oxadiazole;1,4-dimethylpyrazole;3,5-dimethyl-1,2,4-thiadiazole;ethane;5-methyl-1H-imidazole;4-methyl-1,2-oxazole;4-methyl-1,3-oxazole;5-methyl-1H-pyrazole;3-methyl-1H-pyrrole;4-methyl-1,2-thiazole;4-methyl-1,3-thiazole
CID 157083907
bis(4,5-dimethyloxadiazole);1,3-dimethylpyrrole;4,5-dimethyl-2H-triazole;ethane;methane;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;5-methyl-1H-imidazole;2-methyl-1,3,4-oxadiazole;2-methyl-1,3-oxazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-1H-pyrrole;2-methyl-1,3,4-thiadiazole;3-methyl-1,2,4-thiadiazole;4-methylthiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;2-methyl-1,3-thiazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;4-methyl-1,3-thiazole;5-methyl-1,2-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene
CID 157089703
1,2-dimethylimidazole;1,5-dimethylimidazole;bis(4,5-dimethyl-1H-imidazole);bis(3,4-dimethyl-1,2-oxazole);bis(4,5-dimethyl-1,3-oxazole);bis(1,5-dimethylpyrazole);bis(4,5-dimethyl-1H-pyrazole);1,5-dimethyltetrazole;bis(3,4-dimethyl-1,2-thiazole);bis(4,5-dimethyl-1,3-thiazole);1,5-dimethyltriazole;1,5-dimethyl-1,2,4-triazole;3,4-dimethyl-1,2,4-triazole;ethane
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furan;bis(1H-imidazole);1,3,4-oxadiazole;1,2-oxazole;1,3-oxazole;1H-pyrazole;1H-pyrrole;2H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1H-1,2,4-triazole
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CID 157203556
furan;1H-imidazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,2-oxazole;1,3-oxazole;1H-pyrazole;1H-pyrrole;1,2,4-thiadiazole;1,3,4-thiadiazole;1,2-thiazole;1,3-thiazole;thiophene;tris(1H-1,2,4-triazole);2H-triazole
CID 157217425
ethane;furan;1H-imidazole;1,2,4-oxadiazole;1,2-oxazole;1,3-oxazole;1H-pyrazole;1H-pyrrole;1,2,4-thiadiazole;1,2-thiazole;1,3-thiazole;thiophene;1H-1,2,4-triazole
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furan;1H-imidazole;bis(1,2-oxazole);1,3-oxazole;bis(1H-pyrazole);bis(1H-pyrrole);bis(1,2-thiazole);thiophene
CID 157227996
1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;1-methyl-5-(2-methylpropyl)imidazole;1-methyl-3-(2-methylpropyl)pyrazole;1-methyl-4-(2-methylpropyl)pyrazole;1-methyl-5-(2-methylpropyl)pyrazole;2-methyl-5-(2-methylpropyl)tetrazole;1-methyl-4-(2-methylpropyl)triazole;2-(2-methylpropyl)-1,3-oxazole;3-(2-methylpropyl)-1,2-oxazole;4-(2-methylpropyl)-1,2-oxazole;4-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1,2-oxazole;5-(2-methylpropyl)-1,3-oxazole;5-(2-methylpropyl)-1H-pyrazole;2-(2-methylpropyl)-1,3-thiazole;3-(2-methylpropyl)-1,2-thiazole;4-(2-methylpropyl)-1,2-thiazole;4-(2-methylpropyl)-1,3-thiazole;5-(2-methylpropyl)-1,2-thiazole;5-(2-methylpropyl)-1,3-thiazole;5-(2-methylpropyl)-1H-1,2,4-triazole
CID 157379214

Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine?
The IUPAC name of 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine (CID 158177763) is 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine.
What is the SMILES notation for 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine?
The canonical SMILES for 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine is C1=NN=C(CN(CC2=NN=CC2)CC2=NN=CC2)C1.Cn1ccc(CN(Cc2ccn[nH]2)Cc2ccn[nH]2)n1.Cn1ccnc1CN(Cc1nccn1C)Cc1nccn1C.Cn1cnc(CN(Cc2cn(C)cn2)Cc2cn(C)cn2)c1.c1cc(CN(Cc2ccon2)Cc2ccon2)no1.c1cc(CN(Cc2ccsn2)Cc2ccsn2)ns1.c1nc(CN(Cc2cocn2)Cc2cocn2)co1.c1nc(CN(Cc2cscn2)Cc2cscn2)cs1.c1ncc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)[nH]1.c1nnc(CN(Cc2nnco2)Cc2nnco2)o1.c1nnc(CN(Cc2nncs2)Cc2nncs2)s1.c1nonc1CN(Cc1cnon1)Cc1cnon1.c1nsnc1CN(Cc1cnsn1)Cc1cnsn1.
What is the InChIKey of 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine?
The InChIKey is FYEZQPWKWKOBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H21N7.C13H17N7.2C12H15N7.2C12H12N4O3.2C12H12N4S3.2C9H9N7O3.2C9H9N7S3/c1-19-4-13(16-10-19)7-22(8-14-5-20(2)11-17-14)9-15-6-21(3)12-18-15;1-19-7-4-16-13(19)10-22(11-14-17-5-8-20(14)2)12-15-18-6-9-21(15)3;1-19-7-4-13(18-19)10-20(8-11-2-5-14-16-11)9-12-3-6-15-17-12;1-10(16-7-13-1)4-19(5-11-2-14-8-17-11)6-12-3-15-9-18-12;1-4-13-16-10(1)7-19(8-11-2-5-14-17-11)9-12-3-6-15-18-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(10-4-17-7-13-10)16(2-11-5-18-8-14-11)3-12-6-19-9-15-12;1-4-17-13-10(1)7-16(8-11-2-5-18-14-11)9-12-3-6-19-15-12;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9;1(7-13-10-4-17-7)16(2-8-14-11-5-18-8)3-9-15-12-6-19-9;1-7(13-17-10-1)4-16(5-8-2-11-18-14-8)6-9-3-12-19-15-9/h4-6,10-12H,7-9H2,1-3H3;4-9H,10-12H2,1-3H3;2-7H,8-10H2,1H3,(H,14,16)(H,15,17);1-3,7-9H,4-6H2,(H,13,16)(H,14,17)(H,15,18);4-6H,1-3,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-9H,1-3H2;1-6H,7-9H2;4-6H,1-3H2;1-3H,4-6H2;4-6H,1-3H2;1-3H,4-6H2.
What are the key properties of 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine?
1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine has a molecular weight of 3671.39 g/mol, XLogP of 18.27, 78 rotatable bonds, 5 hydrogen bond donors, and 98 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1-methylpyrazol-3-yl)-N,N-bis(1H-pyrazol-5-ylmethyl)methanamine;1-(1,2,5-oxadiazol-3-yl)-N,N-bis(1,2,5-oxadiazol-3-ylmethyl)methanamine;1-(1,3,4-oxadiazol-2-yl)-N,N-bis(1,3,4-oxadiazol-2-ylmethyl)methanamine;1-(1,2-oxazol-3-yl)-N,N-bis(1,2-oxazol-3-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-(4H-pyrazol-3-yl)-N,N-bis(4H-pyrazol-3-ylmethyl)methanamine;1-(1,2,5-thiadiazol-3-yl)-N,N-bis(1,2,5-thiadiazol-3-ylmethyl)methanamine;1-(1,3,4-thiadiazol-2-yl)-N,N-bis(1,3,4-thiadiazol-2-ylmethyl)methanamine;1-(1,2-thiazol-3-yl)-N,N-bis(1,2-thiazol-3-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine is sourced from PubChem (CID 158177763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).