N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole

C109H149N33S4 — CID 157250186

IUPACN,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole
SMILESCC1=NC(C)C(C)N1.CC1=NCCCC1.CC1=NCCCN1.CC1CCc2cccnc2N1.CNc1cccc(C)n1.CNc1ccnc(C)n1.CNc1nc(C)cs1.CNc1ncc(C)[nH]1.Cc1ccc2c(n1)NCCC2.Cc1ccccn1.Cc1nc(C)c(C)[nH]1.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2s1.Cc1nc2ncccc2[nH]1.Cc1nc2ncccc2s1.Cc1ncccn1.Cc1nccs1
InChIInChI=1S/2C9H12N2.C8H8N2.C8H7NS.C7H7N3.C7H6N2S.C7H10N2.C6H9N3.C6H12N2.C6H10N2.C6H11N.C6H7N.C5H9N3.C5H8N2S.C5H10N2.C5H6N2.C4H5NS/c2*1-7-4-5-8-3-2-6-10-9(8)11-7;2*1-6-9-7-4-2-3-5-8(7)10-6;1-5-9-6-3-2-4-8-7(6)10-5;1-5-9-7-6(10-5)3-2-4-8-7;1-6-4-3-5-7(8-2)9-6;1-5-8-4-3-6(7-2)9-5;2*1-4-5(2)8-6(3)7-4;2*1-6-4-2-3-5-7-6;1-4-3-7-5(6-2)8-4;1-4-3-8-5(6-2)7-4;2*1-5-6-3-2-4-7-5;1-4-5-2-3-6-4/h4-5H,2-3,6H2,1H3,(H,10,11);2-3,6-7H,4-5H2,1H3,(H,10,11);2-5H,1H3,(H,9,10);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;3-5H,1-2H3,(H,8,9);3-4H,1-2H3,(H,7,8,9);4-5H,1-3H3,(H,7,8);1-3H3,(H,7,8);2-5H2,1H3;2-5H,1H3;3H,1-2H3,(H2,6,7,8);3H,1-2H3,(H,6,7);2-4H2,1H3,(H,6,7);2-4H,1H3;2-3H,1H3
InChIKeyAWGBGTSGKFYDSX-UHFFFAOYSA-N
MW2049.89 g/mol
LogP23.61
Rot. Bonds4

About N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole

N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole (PubChem CID 157250186) has the molecular formula C109H149N33S4 and a molecular weight of 2049.89 g/mol. Its IUPAC name is N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole.

Molecular Properties

Compound NameN,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole
PubChem CID157250186
Molecular FormulaC109H149N33S4
Molecular Weight2049.89 g/mol
Exact Mass2048.16
IUPAC NameN,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole
SMILESCC1=NC(C)C(C)N1.CC1=NCCCC1.CC1=NCCCN1.CC1CCc2cccnc2N1.CNc1cccc(C)n1.CNc1ccnc(C)n1.CNc1nc(C)cs1.CNc1ncc(C)[nH]1.Cc1ccc2c(n1)NCCC2.Cc1ccccn1.Cc1nc(C)c(C)[nH]1.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2s1.Cc1nc2ncccc2[nH]1.Cc1nc2ncccc2s1.Cc1ncccn1.Cc1nccs1
InChIInChI=1S/2C9H12N2.C8H8N2.C8H7NS.C7H7N3.C7H6N2S.C7H10N2.C6H9N3.C6H12N2.C6H10N2.C6H11N.C6H7N.C5H9N3.C5H8N2S.C5H10N2.C5H6N2.C4H5NS/c2*1-7-4-5-8-3-2-6-10-9(8)11-7;2*1-6-9-7-4-2-3-5-8(7)10-6;1-5-9-6-3-2-4-8-7(6)10-5;1-5-9-7-6(10-5)3-2-4-8-7;1-6-4-3-5-7(8-2)9-6;1-5-8-4-3-6(7-2)9-5;2*1-4-5(2)8-6(3)7-4;2*1-6-4-2-3-5-7-6;1-4-3-7-5(6-2)8-4;1-4-3-8-5(6-2)7-4;2*1-5-6-3-2-4-7-5;1-4-5-2-3-6-4/h4-5H,2-3,6H2,1H3,(H,10,11);2-3,6-7H,4-5H2,1H3,(H,10,11);2-5H,1H3,(H,9,10);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;3-5H,1-2H3,(H,8,9);3-4H,1-2H3,(H,7,8,9);4-5H,1-3H3,(H,7,8);1-3H3,(H,7,8);2-5H2,1H3;2-5H,1H3;3H,1-2H3,(H2,6,7,8);3H,1-2H3,(H,6,7);2-4H2,1H3,(H,6,7);2-4H,1H3;2-3H,1H3
InChIKeyAWGBGTSGKFYDSX-UHFFFAOYSA-N
XLogP23.61
TPSA428.50 Ų
H-Bond Donors12
H-Bond Acceptors33
Rotatable Bonds4
Heavy Atoms146
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002049.89
LogP ≤ 523.61
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1033

Analyze N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole?
The IUPAC name of N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole (CID 157250186) is N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole.
What is the SMILES notation for N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole?
The canonical SMILES for N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole is CC1=NC(C)C(C)N1.CC1=NCCCC1.CC1=NCCCN1.CC1CCc2cccnc2N1.CNc1cccc(C)n1.CNc1ccnc(C)n1.CNc1nc(C)cs1.CNc1ncc(C)[nH]1.Cc1ccc2c(n1)NCCC2.Cc1ccccn1.Cc1nc(C)c(C)[nH]1.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2s1.Cc1nc2ncccc2[nH]1.Cc1nc2ncccc2s1.Cc1ncccn1.Cc1nccs1.
What is the InChIKey of N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole?
The InChIKey is AWGBGTSGKFYDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H12N2.C8H8N2.C8H7NS.C7H7N3.C7H6N2S.C7H10N2.C6H9N3.C6H12N2.C6H10N2.C6H11N.C6H7N.C5H9N3.C5H8N2S.C5H10N2.C5H6N2.C4H5NS/c2*1-7-4-5-8-3-2-6-10-9(8)11-7;2*1-6-9-7-4-2-3-5-8(7)10-6;1-5-9-6-3-2-4-8-7(6)10-5;1-5-9-7-6(10-5)3-2-4-8-7;1-6-4-3-5-7(8-2)9-6;1-5-8-4-3-6(7-2)9-5;2*1-4-5(2)8-6(3)7-4;2*1-6-4-2-3-5-7-6;1-4-3-7-5(6-2)8-4;1-4-3-8-5(6-2)7-4;2*1-5-6-3-2-4-7-5;1-4-5-2-3-6-4/h4-5H,2-3,6H2,1H3,(H,10,11);2-3,6-7H,4-5H2,1H3,(H,10,11);2-5H,1H3,(H,9,10);2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3;3-5H,1-2H3,(H,8,9);3-4H,1-2H3,(H,7,8,9);4-5H,1-3H3,(H,7,8);1-3H3,(H,7,8);2-5H2,1H3;2-5H,1H3;3H,1-2H3,(H2,6,7,8);3H,1-2H3,(H,6,7);2-4H2,1H3,(H,6,7);2-4H,1H3;2-3H,1H3.
What are the key properties of N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole?
N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole has a molecular weight of 2049.89 g/mol, XLogP of 23.61, 4 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1H-imidazol-2-amine;N,6-dimethylpyridin-2-amine;N,2-dimethylpyrimidin-4-amine;N,4-dimethyl-1,3-thiazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1H-imidazo[4,5-b]pyridine;2-methylpyridine;2-methylpyrimidine;2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-methyl-2,3,4,5-tetrahydropyridine;2-methyl-1,4,5,6-tetrahydropyrimidine;2-methyl-1,3-thiazole;2-methyl-[1,3]thiazolo[4,5-b]pyridine;2,4,5-trimethyl-4,5-dihydro-1H-imidazole;2,4,5-trimethyl-1H-imidazole is sourced from PubChem (CID 157250186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).