2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine

C17H12Cl2N6O — CID 67383145

IUPAC2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
SMILESCOc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1
InChIInChI=1S/C17H12Cl2N6O/c1-26-13-7-12(21-8-22-13)24-17-15-11(5-6-20-17)23-16(25-15)14-9(18)3-2-4-10(14)19/h2-8H,1H3,(H,23,25)(H,20,21,22,24)
InChIKeyOANXOEXNBCTCLW-UHFFFAOYSA-N
MW387.23 g/mol
LogP4.47
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine

2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine (PubChem CID 67383145) has the molecular formula C17H12Cl2N6O and a molecular weight of 387.23 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
PubChem CID67383145
Molecular FormulaC17H12Cl2N6O
Molecular Weight387.23 g/mol
Exact Mass386.04
IUPAC Name2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
SMILESCOc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1
InChIInChI=1S/C17H12Cl2N6O/c1-26-13-7-12(21-8-22-13)24-17-15-11(5-6-20-17)23-16(25-15)14-9(18)3-2-4-10(14)19/h2-8H,1H3,(H,23,25)(H,20,21,22,24)
InChIKeyOANXOEXNBCTCLW-UHFFFAOYSA-N
XLogP4.47
TPSA88.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.23
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,6-dichlorophenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 53373594
2-(2,6-dichlorophenyl)-N-pyrimidin-4-yl-1H-imidazo[4,5-c]pyridin-4-amine
CID 53476104
4-N-[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]pyrimidine-4,6-diamine
CID 67383086
2-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridine-4-carbonitrile
CID 67383227
1-[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyrimidin-4-yl]piperidin-4-ol
CID 67383552
2-(2,6-dichlorophenyl)-N-(6-methylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67383612
3,5-dichloro-4-(4-(6-methylpyrimidin-4-ylamino)-3H-imidazo[4,5-c]pyridin-2-yl)benzonitrile
CID 67383875
N4-(2-(2,6-Dichlorophenyl)-3H-imidazo[4,5-c]pyridin-4-yl)-N6-methylpyrimidine-4,6-diamine
CID 67383893
2-(2,6-dichlorophenyl)-N-(6-pyrrolidin-1-ylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 68234726
6-N-[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 71222450
4-[4-[(6-aminopyrimidin-4-yl)amino]-1H-imidazo[4,5-c]pyridin-2-yl]-3,5-dichlorobenzonitrile
CID 89498235
3,5-dichloro-4-[4-[[6-(methylamino)pyrimidin-4-yl]amino]-1H-imidazo[4,5-c]pyridin-2-yl]benzonitrile
CID 137635710

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine (CID 67383145) is 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine is COc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncn1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The InChIKey is OANXOEXNBCTCLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N6O/c1-26-13-7-12(21-8-22-13)24-17-15-11(5-6-20-17)23-16(25-15)14-9(18)3-2-4-10(14)19/h2-8H,1H3,(H,23,25)(H,20,21,22,24).
What are the key properties of 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine has a molecular weight of 387.23 g/mol, XLogP of 4.47, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(6-methoxypyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 67383145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).