2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide

C17H19N7O — CID 143223137

IUPAC2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide
SMILESCc1nc(N)cc(Nc2ncc(C(=O)Nc3c(C)cccc3C)[nH]2)n1
InChIInChI=1S/C17H19N7O/c1-9-5-4-6-10(2)15(9)24-16(25)12-8-19-17(22-12)23-14-7-13(18)20-11(3)21-14/h4-8H,1-3H3,(H,24,25)(H4,18,19,20,21,22,23)
InChIKeyDGKDSICVFWTFPO-UHFFFAOYSA-N
MW337.39 g/mol
LogP2.70
Rot. Bonds4

About 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide

2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide (PubChem CID 143223137) has the molecular formula C17H19N7O and a molecular weight of 337.39 g/mol. Its IUPAC name is 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide.

Molecular Properties

Compound Name2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide
PubChem CID143223137
Molecular FormulaC17H19N7O
Molecular Weight337.39 g/mol
Exact Mass337.17
IUPAC Name2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide
SMILESCc1nc(N)cc(Nc2ncc(C(=O)Nc3c(C)cccc3C)[nH]2)n1
InChIInChI=1S/C17H19N7O/c1-9-5-4-6-10(2)15(9)24-16(25)12-8-19-17(22-12)23-14-7-13(18)20-11(3)21-14/h4-8H,1-3H3,(H,24,25)(H4,18,19,20,21,22,23)
InChIKeyDGKDSICVFWTFPO-UHFFFAOYSA-N
XLogP2.70
TPSA121.61 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 52.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide with MolForge

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Related Compounds

N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]-1H-imidazole-5-carboxamide
CID 72705320
N-(2-chloro-6-methylphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390702
7-amino-N-(2-chloro-6-methylphenyl)-1H-indole-2-carboxamide
CID 66251996
N-(2-chloro-6-methylphenyl)-2-[(6-chloro-2-methylpyrimidin-4-yl)amino]-1,3-thiazole-5-carboxamide
CID 11269410
N-(2,6-dimethylphenyl)-6-methyl-1H-indole-2-carboxamide
CID 113207344
6-(3,4-difluoroanilino)-N-(2,6-dimethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 112849232
N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-(methylideneamino)pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide
CID 143223112
2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 114921441
N-[3-[[6-(2,6-dimethylanilino)-2-methylpyrimidin-4-yl]amino]phenyl]acetamide
CID 112877486
(2S)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)propanamide
CID 865761
5-amino-N-(2-chloro-6-methylphenyl)pyrazine-2-carboxamide
CID 107376052
N-(2,6-dimethylphenyl)-6-(2-methoxy-5-methylanilino)-2-methylpyrimidine-4-carboxamide
CID 112849207

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide?
The IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide (CID 143223137) is 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide.
What is the SMILES notation for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide?
The canonical SMILES for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide is Cc1nc(N)cc(Nc2ncc(C(=O)Nc3c(C)cccc3C)[nH]2)n1.
What is the InChIKey of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide?
The InChIKey is DGKDSICVFWTFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7O/c1-9-5-4-6-10(2)15(9)24-16(25)12-8-19-17(22-12)23-14-7-13(18)20-11(3)21-14/h4-8H,1-3H3,(H,24,25)(H4,18,19,20,21,22,23).
What are the key properties of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide?
2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide has a molecular weight of 337.39 g/mol, XLogP of 2.70, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-(2,6-dimethylphenyl)-1H-imidazole-5-carboxamide is sourced from PubChem (CID 143223137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).