N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide

C18H16N4O — CID 71943773

IUPACN-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide
SMILESO=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccncc1
InChIInChI=1S/C18H16N4O/c23-18(14-8-10-19-11-9-14)20-17-12-16(13-6-7-13)21-22(17)15-4-2-1-3-5-15/h1-5,8-13H,6-7H2,(H,20,23)
InChIKeyMTSHZHSJQDAKSH-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.40
Rot. Bonds4

About N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide

N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide (PubChem CID 71943773) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide
PubChem CID71943773
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC NameN-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide
SMILESO=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccncc1
InChIInChI=1S/C18H16N4O/c23-18(14-8-10-19-11-9-14)20-17-12-16(13-6-7-13)21-22(17)15-4-2-1-3-5-15/h1-5,8-13H,6-7H2,(H,20,23)
InChIKeyMTSHZHSJQDAKSH-UHFFFAOYSA-N
XLogP3.40
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 ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(3-cyclopropyl-1-phenylpyrazol-5-yl)benzamide
CID 134797164
4-acetamido-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)benzamide
CID 78830462
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-4-[(prop-2-enoylamino)methyl]benzamide
CID 166403509
2-chloro-N-(3-cyclopropyl-1-phenylpyrazol-5-yl)acetamide
CID 2778369
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-(tetrazol-1-yl)benzamide
CID 78830472
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide
CID 51111472
N'-benzoyl-3-cyclopropyl-1-phenylpyrazole-5-carbohydrazide
CID 27555772
[2-[(3-cyclopropyl-1-phenylpyrazol-5-yl)amino]-2-oxoethyl] 2-benzamido-2-phenylacetate
CID 55553271
phenyl N-(3-cyclobutyl-1-phenylpyrazol-5-yl)carbamate
CID 66876742
2-amino-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide;hydrochloride
CID 119268734
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-[3-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 111543790
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
CID 37206869

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide?
The IUPAC name of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide (CID 71943773) is N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide is O=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccncc1.
What is the InChIKey of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide?
The InChIKey is MTSHZHSJQDAKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c23-18(14-8-10-19-11-9-14)20-17-12-16(13-6-7-13)21-22(17)15-4-2-1-3-5-15/h1-5,8-13H,6-7H2,(H,20,23).
What are the key properties of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide?
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 71943773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).