N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide

C18H13ClN4O — CID 46882617

IUPACN-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cnn2ccc(-n3cccc3)cc12
InChIInChI=1S/C18H13ClN4O/c19-15-5-1-2-6-16(15)21-18(24)14-12-20-23-10-7-13(11-17(14)23)22-8-3-4-9-22/h1-12H,(H,21,24)
InChIKeyZABSTLOUKWTRLB-UHFFFAOYSA-N
MW336.78 g/mol
LogP4.03
Rot. Bonds3

About N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide

N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 46882617) has the molecular formula C18H13ClN4O and a molecular weight of 336.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID46882617
Molecular FormulaC18H13ClN4O
Molecular Weight336.78 g/mol
Exact Mass336.08
IUPAC NameN-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cnn2ccc(-n3cccc3)cc12
InChIInChI=1S/C18H13ClN4O/c19-15-5-1-2-6-16(15)21-18(24)14-12-20-23-10-7-13(11-17(14)23)22-8-3-4-9-22/h1-12H,(H,21,24)
InChIKeyZABSTLOUKWTRLB-UHFFFAOYSA-N
XLogP4.03
TPSA51.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.78
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 46175112
2-(2-Chlorophenyl)-2H-indazole-7-carboxamide
CID 44549373
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 16324174
N-(3-fluoro-4-pyridinyl)-2-phenylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 165415060
4-[4-(2,3-dichlorophenyl)piperazin-1-yl]-N-(3-formylpyrazolo[1,5-a]pyridin-5-yl)butanamide
CID 137636351
N-[2-(4-chlorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16194125
2,3-Dihydroindol-1-yl(pyrazolo[1,5-a]pyridin-3-yl)methanone
CID 5308192
3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-6-[(1-methylpyrazol-3-yl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 15950750
N-[2-(2-chlorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16024956
2-(5-(1-(2-chlorophenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-5-carbonyl)-1H-indol-3-yl)-N,N-dimethyl-2-oxoacetamide
CID 25114098
(1-(2-chlorophenyl)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridin-5(4H)-yl)(1-methyl-1H-indol-5-yl)methanone
CID 44426955
(6-chloro-1-methyl-1H-indol-5-yl)(1-(2-chlorophenyl)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridin-5(4H)-yl)methanone
CID 44426958

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide (CID 46882617) is N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide is O=C(Nc1ccccc1Cl)c1cnn2ccc(-n3cccc3)cc12.
What is the InChIKey of N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is ZABSTLOUKWTRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN4O/c19-15-5-1-2-6-16(15)21-18(24)14-12-20-23-10-7-13(11-17(14)23)22-8-3-4-9-22/h1-12H,(H,21,24).
What are the key properties of N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 336.78 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-5-pyrrol-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 46882617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).