N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide

C16H12FN5O2 — CID 59733537

IUPACN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1ccccn1
InChIInChI=1S/C16H12FN5O2/c17-10-4-6-11(7-5-10)20-16(24)14-13(9-19-22-14)21-15(23)12-3-1-2-8-18-12/h1-9H,(H,19,22)(H,20,24)(H,21,23)
InChIKeyUJTZQAPQUHXTJX-UHFFFAOYSA-N
MW325.30 g/mol
LogP2.45
Rot. Bonds4

About N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide

N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide (PubChem CID 59733537) has the molecular formula C16H12FN5O2 and a molecular weight of 325.30 g/mol. Its IUPAC name is N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide
PubChem CID59733537
Molecular FormulaC16H12FN5O2
Molecular Weight325.30 g/mol
Exact Mass325.10
IUPAC NameN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1ccccn1
InChIInChI=1S/C16H12FN5O2/c17-10-4-6-11(7-5-10)20-16(24)14-13(9-19-22-14)21-15(23)12-3-1-2-8-18-12/h1-9H,(H,19,22)(H,20,24)(H,21,23)
InChIKeyUJTZQAPQUHXTJX-UHFFFAOYSA-N
XLogP2.45
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.30
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2,6-difluorobenzoyl)amino]-N-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 24864079
N-[5-(cyanomethylcarbamoyl)-1H-pyrazol-4-yl]pyridine-2-carboxamide
CID 86631239
N-(4-fluorophenyl)-4-(methanesulfonamido)-1H-pyrazole-5-carboxamide
CID 59733321
N-(4-fluorophenyl)-4-[(3-nitrobenzoyl)amino]-1H-pyrazole-5-carboxamide
CID 59733390
4-amino-N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-1-methylimidazole-2-carboxamide
CID 59733306
N-(4-pyridin-2-ylphenyl)pyridine-2-carboxamide
CID 110461625
N-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]pyridine-2-carboxamide
CID 10493507
N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide
CID 163784998
N-[5-[[6-(trifluoromethyl)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
CID 154654515
N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 2571943
N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
4-(pyridine-2-carbonylamino)benzoic acid
CID 16770258

Frequently Asked Questions

What is the IUPAC name of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide (CID 59733537) is N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide is O=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1ccccn1.
What is the InChIKey of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide?
The InChIKey is UJTZQAPQUHXTJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN5O2/c17-10-4-6-11(7-5-10)20-16(24)14-13(9-19-22-14)21-15(23)12-3-1-2-8-18-12/h1-9H,(H,19,22)(H,20,24)(H,21,23).
What are the key properties of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide?
N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide has a molecular weight of 325.30 g/mol, XLogP of 2.45, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 59733537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).