2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine

C17H14Cl2N6 — CID 67388167

IUPAC2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
SMILESCc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)n(C)n1
InChIInChI=1S/C17H14Cl2N6/c1-9-8-13(25(2)24-9)22-17-15-12(6-7-20-17)21-16(23-15)14-10(18)4-3-5-11(14)19/h3-8H,1-2H3,(H,20,22)(H,21,23)
InChIKeyFXWSXLWDSHNYCG-UHFFFAOYSA-N
MW373.25 g/mol
LogP4.72
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine

2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine (PubChem CID 67388167) has the molecular formula C17H14Cl2N6 and a molecular weight of 373.25 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
PubChem CID67388167
Molecular FormulaC17H14Cl2N6
Molecular Weight373.25 g/mol
Exact Mass372.07
IUPAC Name2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
SMILESCc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)n(C)n1
InChIInChI=1S/C17H14Cl2N6/c1-9-8-13(25(2)24-9)22-17-15-12(6-7-20-17)21-16(23-15)14-10(18)4-3-5-11(14)19/h3-8H,1-2H3,(H,20,22)(H,21,23)
InChIKeyFXWSXLWDSHNYCG-UHFFFAOYSA-N
XLogP4.72
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.25
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine (CID 67388167) is 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine is Cc1cc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)n(C)n1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
The InChIKey is FXWSXLWDSHNYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N6/c1-9-8-13(25(2)24-9)22-17-15-12(6-7-20-17)21-16(23-15)14-10(18)4-3-5-11(14)19/h3-8H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine?
2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine has a molecular weight of 373.25 g/mol, XLogP of 4.72, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 67388167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).