N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide

C16H12Cl2N4O — CID 90343287

IUPACN-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESO=C(NC1CC1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H12Cl2N4O/c17-11-6-5-10(8-12(11)18)22-14-13(2-1-7-19-14)21-15(22)16(23)20-9-3-4-9/h1-2,5-9H,3-4H2,(H,20,23)
InChIKeyLZTJYRYBQLTRFF-UHFFFAOYSA-N
MW347.21 g/mol
LogP3.62
Rot. Bonds3

About N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide

N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide (PubChem CID 90343287) has the molecular formula C16H12Cl2N4O and a molecular weight of 347.21 g/mol. Its IUPAC name is N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide
PubChem CID90343287
Molecular FormulaC16H12Cl2N4O
Molecular Weight347.21 g/mol
Exact Mass346.04
IUPAC NameN-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESO=C(NC1CC1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H12Cl2N4O/c17-11-6-5-10(8-12(11)18)22-14-13(2-1-7-19-14)21-15(22)16(23)20-9-3-4-9/h1-2,5-9H,3-4H2,(H,20,23)
InChIKeyLZTJYRYBQLTRFF-UHFFFAOYSA-N
XLogP3.62
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.21
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 118710459
7,8-Dichloropyrido[1,2-a]benzimidazole
CID 915136
1-[2-(4-chloroanilino)-2-oxoethyl]-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide
CID 11442390
2-(4-chlorophenyl)-N-(3-pyridinyl)-3H-imidazo[4,5-b]pyridine-3-acetamide
CID 14390216
2-(4-Chlorophenyl)-N-(2-pyridinyl)-3H-imidazo[4,5-b]pyridine-3-acetamide
CID 14390286
N-(4-chlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024165
N-(3,4-dichlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024167
3-(3-Chloro-4-methylphenyl)-N-cyclopropyl-3H-imidazo[4,5-b]pyridine-2-carboxamide
CID 90343271
N-(4-chlorophenyl)-2-[2-(1H-pyrrol-2-yl)benzimidazol-1-yl]acetamide
CID 136042356
1-amino-N-(4-chlorophenyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 168284907
N-[(1S,2R)-2-[[6-(3-chloroanilino)-9-ethylpurin-2-yl]amino]cyclohexyl]acetamide
CID 137632510
N-(4-chlorophenyl)-1-(2-(pyridin-4-yl)ethyl)-1H-imidazole-2-carboxamide
CID 44431920

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide (CID 90343287) is N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide is O=C(NC1CC1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The InChIKey is LZTJYRYBQLTRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N4O/c17-11-6-5-10(8-12(11)18)22-14-13(2-1-7-19-14)21-15(22)16(23)20-9-3-4-9/h1-2,5-9H,3-4H2,(H,20,23).
What are the key properties of N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide?
N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide has a molecular weight of 347.21 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridine-2-carboxamide is sourced from PubChem (CID 90343287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).