1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine

C84H142N46O8 — CID 159574770

IUPAC1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine
SMILESC/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.C/N=C(/N=C(N)N)NCc1ccc(C)o1.C/N=C(\N)N/C(N)=N/Cc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)Cc1ccc(C)o1.Cc1ccc(C/N=C(\N)N=C(N)N(C)C)[nH]1.Cc1ccc(C/N=C(\N)N=C(N)N)o1.[H]/N=C(/N(C)Cc1ccc(C)o1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccc(C)o1
InChIInChI=1S/C10H18N6.3C10H17N5O.4C9H15N5O.C8H13N5O/c1-7-4-5-8(14-7)6-13-9(11)15-10(12)16(2)3;1-7-4-5-8(16-7)6-15(3)10(12)14-9(11)13-2;1-7-4-5-8(16-7)6-14(2)10(13)15(3)9(11)12;1-7-4-5-8(16-7)6-15(3)10(13-2)14-9(11)12;1-6-3-4-7(15-6)5-13-9(11)14-8(10)12-2;1-6-3-4-7(15-6)5-14(2)9(12)13-8(10)11;1-6-3-4-7(15-6)5-13-9(12)14(2)8(10)11;1-6-3-4-7(15-6)5-13-9(12-2)14-8(10)11;1-5-2-3-6(14-5)4-12-8(11)13-7(9)10/h4-5,14H,6H2,1-3H3,(H4,11,12,13,15);4-5H,6H2,1-3H3,(H4,11,12,13,14);4-5,13H,6H2,1-3H3,(H3,11,12);4-5H,6H2,1-3H3,(H4,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13);3-4H,5H2,1-2H3,(H3,10,11)(H2,12,13);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);2-3H,4H2,1H3,(H6,9,10,11,12,13)/b;;13-10-;;;;;;
InChIKeyMIGLYGPXWKBLOF-ZCBDOWLMSA-N
MW1924.37 g/mol
LogP1.36
Rot. Bonds18

About 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine

1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine (PubChem CID 159574770) has the molecular formula C84H142N46O8 and a molecular weight of 1924.37 g/mol. Its IUPAC name is 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine.

Molecular Properties

Compound Name1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine
PubChem CID159574770
Molecular FormulaC84H142N46O8
Molecular Weight1924.37 g/mol
Exact Mass1923.21
IUPAC Name1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine
SMILESC/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.C/N=C(/N=C(N)N)NCc1ccc(C)o1.C/N=C(\N)N/C(N)=N/Cc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)Cc1ccc(C)o1.Cc1ccc(C/N=C(\N)N=C(N)N(C)C)[nH]1.Cc1ccc(C/N=C(\N)N=C(N)N)o1.[H]/N=C(/N(C)Cc1ccc(C)o1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccc(C)o1
InChIInChI=1S/C10H18N6.3C10H17N5O.4C9H15N5O.C8H13N5O/c1-7-4-5-8(14-7)6-13-9(11)15-10(12)16(2)3;1-7-4-5-8(16-7)6-15(3)10(12)14-9(11)13-2;1-7-4-5-8(16-7)6-14(2)10(13)15(3)9(11)12;1-7-4-5-8(16-7)6-15(3)10(13-2)14-9(11)12;1-6-3-4-7(15-6)5-13-9(11)14-8(10)12-2;1-6-3-4-7(15-6)5-14(2)9(12)13-8(10)11;1-6-3-4-7(15-6)5-13-9(12)14(2)8(10)11;1-6-3-4-7(15-6)5-13-9(12-2)14-8(10)11;1-5-2-3-6(14-5)4-12-8(11)13-7(9)10/h4-5,14H,6H2,1-3H3,(H4,11,12,13,15);4-5H,6H2,1-3H3,(H4,11,12,13,14);4-5,13H,6H2,1-3H3,(H3,11,12);4-5H,6H2,1-3H3,(H4,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13);3-4H,5H2,1-2H3,(H3,10,11)(H2,12,13);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);2-3H,4H2,1H3,(H6,9,10,11,12,13)/b;;13-10-;;;;;;
InChIKeyMIGLYGPXWKBLOF-ZCBDOWLMSA-N
XLogP1.36
TPSA904.45 Ų
H-Bond Donors25
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001924.37
LogP ≤ 51.36
H-Bond Donors ≤ 525
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine with MolForge

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Related Compounds

N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-ylmethyl)-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-(1H-pyrrol-2-ylmethyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-(1H-pyrrol-2-ylmethyl)-1,3,5-triazinane-2,4-diimine;6-N-(furan-2-ylmethyl)-6-N,4-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;2-N-(furan-2-ylmethyl)-4-N,6-dimethyl-1,3,5-triazinane-2,4-diimine;6-(furan-2-ylmethylimino)-2-methyl-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-(1H-pyrrol-2-ylmethylimino)-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-(1H-pyrrol-2-ylmethyl)-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-(1H-pyrrol-2-ylmethyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,N,2-trimethyl-6-(1H-pyrrol-2-ylmethylimino)-2,5-dihydro-1H-1,3,5-triazin-4-amine
CID 157877743
2-N,2-N-dimethyl-4-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 158515158
CID 158854626
CID 158854626
7-N,2-dimethyl-7-N-[2-(1H-pyrrol-2-yl)ethyl]-3,6-dihydro-2H-1,4-diazepine-5,7-diamine;4-N-[2-(furan-2-yl)ethyl]-4-N,6-dimethyl-6,7-dihydro-3H-1,3,5-triazepine-2,4-diamine;2-[2-(furan-2-yl)ethylimino]-6,7-dimethyl-1,3,6,7-tetrahydro-1,3,5-triazepin-4-amine;2-[2-(furan-2-yl)ethylimino]-7-methyl-1,3,6,7-tetrahydro-1,3,5-triazepin-4-amine;4-N-[2-(furan-2-yl)ethyl]-2-N,2-N,4-N,6,7-pentamethyl-6,7-dihydro-3H-1,3,5-triazepine-2,4-diamine;4-N-[2-(furan-2-yl)ethyl]-2-N,2-N,4-N,6-tetramethyl-6,7-dihydro-3H-1,3,5-triazepine-2,4-diamine;4-N-[2-(furan-2-yl)ethyl]-4-N,6,7-trimethyl-6,7-dihydro-3H-1,3,5-triazepine-2,4-diamine;2-methyl-7-[2-(1H-pyrrol-2-yl)ethylimino]-1,2,3,6-tetrahydro-1,4-diazepin-5-amine
CID 158974077
1-carbamimidoyl-1,3-dimethyl-3-(5-methylfuran-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-(5-methylfuran-2-yl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methylfuran-2-yl)guanidine
CID 159133434
6-N,4-dimethyl-6-N-[(5-methylfuran-2-yl)methyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazinane-2,4-diimine;N,2-dimethyl-6-methylimino-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-N,4-dimethyl-6-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;4-N,6-dimethyl-2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazinane-2,4-diimine;2-methyl-6-[(5-methylfuran-2-yl)methylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-methyl-6-[(5-methyl-1H-pyrrol-2-yl)methylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine;4-N,6-N,6-N,2,5-pentamethyl-4-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-2H-1,3,5-triazine-4,6-diamine;2-N,2-N,6-N,4-tetramethyl-6-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine;N,N,2-trimethyl-6-[(5-methyl-1H-pyrrol-2-yl)methylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine
CID 159265095
CID 159422281
CID 159422281
CID 159489791
CID 159489791
CID 159704156
CID 159704156
2-N,4-N-dimethyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N-dimethyl-4-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N-dimethyl-2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N,6-N-dimethyl-2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-methyl-2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;4-N-methyl-2-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N,2-N,4-N,4-N-tetramethyl-6-N-[(5-methyl-1H-pyrrol-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 160200816
CID 160235103
CID 160235103
CID 160238034
CID 160238034

Frequently Asked Questions

What is the IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine?
The IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine (CID 159574770) is 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine.
What is the SMILES notation for 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine?
The canonical SMILES for 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine is C/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.C/N=C(/N=C(N)N)NCc1ccc(C)o1.C/N=C(\N)N/C(N)=N/Cc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)Cc1ccc(C)o1.Cc1ccc(C/N=C(\N)N=C(N)N(C)C)[nH]1.Cc1ccc(C/N=C(\N)N=C(N)N)o1.[H]/N=C(/N(C)Cc1ccc(C)o1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccc(C)o1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccc(C)o1.
What is the InChIKey of 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine?
The InChIKey is MIGLYGPXWKBLOF-ZCBDOWLMSA-N. The full InChI is InChI=1S/C10H18N6.3C10H17N5O.4C9H15N5O.C8H13N5O/c1-7-4-5-8(14-7)6-13-9(11)15-10(12)16(2)3;1-7-4-5-8(16-7)6-15(3)10(12)14-9(11)13-2;1-7-4-5-8(16-7)6-14(2)10(13)15(3)9(11)12;1-7-4-5-8(16-7)6-15(3)10(13-2)14-9(11)12;1-6-3-4-7(15-6)5-13-9(11)14-8(10)12-2;1-6-3-4-7(15-6)5-14(2)9(12)13-8(10)11;1-6-3-4-7(15-6)5-13-9(12)14(2)8(10)11;1-6-3-4-7(15-6)5-13-9(12-2)14-8(10)11;1-5-2-3-6(14-5)4-12-8(11)13-7(9)10/h4-5,14H,6H2,1-3H3,(H4,11,12,13,15);4-5H,6H2,1-3H3,(H4,11,12,13,14);4-5,13H,6H2,1-3H3,(H3,11,12);4-5H,6H2,1-3H3,(H4,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);3-4H,5H2,1-2H3,(H5,10,11,12,13);3-4H,5H2,1-2H3,(H3,10,11)(H2,12,13);3-4H,5H2,1-2H3,(H5,10,11,12,13,14);2-3H,4H2,1H3,(H6,9,10,11,12,13)/b;;13-10-;;;;;;.
What are the key properties of 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine?
1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine has a molecular weight of 1924.37 g/mol, XLogP of 1.36, 18 rotatable bonds, 25 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamimidoyl-1,3-dimethyl-3-[(5-methylfuran-2-yl)methyl]guanidine;1-carbamimidoyl-1-methyl-2-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methylfuran-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methylfuran-2-yl)methyl]guanidine;1,1-dimethyl-2-[N'-[(5-methyl-1H-pyrrol-2-yl)methyl]carbamimidoyl]guanidine;1-(N'-methylcarbamimidoyl)-2-[(5-methylfuran-2-yl)methyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[(5-methylfuran-2-yl)methyl]guanidine is sourced from PubChem (CID 159574770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).