6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide

C18H13Cl2N7O — CID 67383833

IUPAC6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide
SMILESCNC(=O)c1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1
InChIInChI=1S/C18H13Cl2N7O/c1-21-18(28)12-7-13(24-8-23-12)26-17-15-11(5-6-22-17)25-16(27-15)14-9(19)3-2-4-10(14)20/h2-8H,1H3,(H,21,28)(H,25,27)(H,22,23,24,26)
InChIKeyWNHAXOVAZUZZIK-UHFFFAOYSA-N
MW414.26 g/mol
LogP3.82
Rot. Bonds4

About 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide

6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide (PubChem CID 67383833) has the molecular formula C18H13Cl2N7O and a molecular weight of 414.26 g/mol. Its IUPAC name is 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide
PubChem CID67383833
Molecular FormulaC18H13Cl2N7O
Molecular Weight414.26 g/mol
Exact Mass413.06
IUPAC Name6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide
SMILESCNC(=O)c1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1
InChIInChI=1S/C18H13Cl2N7O/c1-21-18(28)12-7-13(24-8-23-12)26-17-15-11(5-6-22-17)25-16(27-15)14-9(19)3-2-4-10(14)20/h2-8H,1H3,(H,21,28)(H,25,27)(H,22,23,24,26)
InChIKeyWNHAXOVAZUZZIK-UHFFFAOYSA-N
XLogP3.82
TPSA108.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.26
LogP ≤ 53.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]-6-N-methylpyrimidine-4,6-diamine
CID 67383893
2-(2,6-dichlorophenyl)-N-(6-methylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67383612
2-[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyrimidin-4-yl]propan-2-ol
CID 67383342
2-(2,6-dichlorophenyl)-N-[6-methyl-2-(trifluoromethyl)pyrimidin-4-yl]-1H-imidazo[4,5-c]pyridin-4-amine
CID 67383768
[2-[[2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-4-pyridinyl]methanol
CID 66803370
N-[6-(azetidin-1-yl)pyrimidin-4-yl]-2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67383622
[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone
CID 67388554
2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67388167
2-(2-chloro-6-fluorophenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67388176
3,5-dichloro-4-[4-[[6-(dimethylamino)pyrimidin-4-yl]amino]-1H-imidazo[4,5-c]pyridin-2-yl]benzonitrile
CID 67383645
[6-[[2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-3-pyridinyl]methanol
CID 67383021
[4-chloro-3-[4-[(6-methylpyrimidin-4-yl)amino]-1H-imidazo[4,5-c]pyridin-2-yl]phenyl]methanol
CID 67383423

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide?
The IUPAC name of 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide (CID 67383833) is 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide.
What is the SMILES notation for 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide?
The canonical SMILES for 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide is CNC(=O)c1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1.
What is the InChIKey of 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide?
The InChIKey is WNHAXOVAZUZZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N7O/c1-21-18(28)12-7-13(24-8-23-12)26-17-15-11(5-6-22-17)25-16(27-15)14-9(19)3-2-4-10(14)20/h2-8H,1H3,(H,21,28)(H,25,27)(H,22,23,24,26).
What are the key properties of 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide?
6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide has a molecular weight of 414.26 g/mol, XLogP of 3.82, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 67383833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).