N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide

C18H16N4O — CID 4171890

IUPACN-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1ccc(-c2cnn(-c3ccccc3)c2)nc1
InChIInChI=1S/C18H16N4O/c23-18(21-15-7-8-15)13-6-9-17(19-10-13)14-11-20-22(12-14)16-4-2-1-3-5-16/h1-6,9-12,15H,7-8H2,(H,21,23)
InChIKeyJRGQLGSRKWREFM-UHFFFAOYSA-N
MW304.35 g/mol
LogP2.83
Rot. Bonds4

About N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide

N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide (PubChem CID 4171890) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide
PubChem CID4171890
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC NameN-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1ccc(-c2cnn(-c3ccccc3)c2)nc1
InChIInChI=1S/C18H16N4O/c23-18(21-15-7-8-15)13-6-9-17(19-10-13)14-11-20-22(12-14)16-4-2-1-3-5-16/h1-6,9-12,15H,7-8H2,(H,21,23)
InChIKeyJRGQLGSRKWREFM-UHFFFAOYSA-N
XLogP2.83
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide
CID 4188027
6-[1-(4-chlorophenyl)pyrazol-4-yl]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 4109180
6-[3-(cyclopropylcarbamoyl)phenyl]pyridine-3-carboxylic acid
CID 53224277
1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide
CID 28742838
6-[1-(4-methylphenyl)pyrazol-4-yl]pyridine-3-carboxylic acid
CID 4236852
1-(4-bromophenyl)-N-cyclopropylpyrazole-4-carboxamide
CID 47242136
N-[4-(cyclohexylcarbamoyl)-2-methylphenyl]-1-phenylpyrazole-4-carboxamide
CID 55880187
N-cyclopropyl-4-[(E)-3-oxo-3-[(1-phenylpyrazol-4-yl)methylamino]prop-1-enyl]benzamide
CID 92851724
N-cycloheptyl-6-(4-fluorophenyl)pyridine-3-carboxamide
CID 53111052
N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1-phenylpyrazole-4-carboxamide
CID 32526900
N-[4-(dimethylcarbamoylamino)cyclohexyl]-6-(3-fluorophenyl)pyridine-3-carboxamide
CID 59401474
6-[1-(4-cyanophenyl)pyrazol-4-yl]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 4268648

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide (CID 4171890) is N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide is O=C(NC1CC1)c1ccc(-c2cnn(-c3ccccc3)c2)nc1.
What is the InChIKey of N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide?
The InChIKey is JRGQLGSRKWREFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c23-18(21-15-7-8-15)13-6-9-17(19-10-13)14-11-20-22(12-14)16-4-2-1-3-5-16/h1-6,9-12,15H,7-8H2,(H,21,23).
What are the key properties of N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide?
N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-(1-phenylpyrazol-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 4171890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).