N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide

C13H13FN4O — CID 155688337

IUPACN-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide
SMILESO=C(Nc1ccn(CC2CC2)n1)c1ccncc1F
InChIInChI=1S/C13H13FN4O/c14-11-7-15-5-3-10(11)13(19)16-12-4-6-18(17-12)8-9-1-2-9/h3-7,9H,1-2,8H2,(H,16,17,19)
InChIKeyNCGSYNSMVFZKBL-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.08
Rot. Bonds4

About N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide

N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide (PubChem CID 155688337) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide
PubChem CID155688337
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC NameN-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide
SMILESO=C(Nc1ccn(CC2CC2)n1)c1ccncc1F
InChIInChI=1S/C13H13FN4O/c14-11-7-15-5-3-10(11)13(19)16-12-4-6-18(17-12)8-9-1-2-9/h3-7,9H,1-2,8H2,(H,16,17,19)
InChIKeyNCGSYNSMVFZKBL-UHFFFAOYSA-N
XLogP2.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-(2-fluorophenyl)-N-(1-pyridin-4-ylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 134596870
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4-fluoro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)benzamide
CID 5193716
2-fluoro-N-(5-phenyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 118716973
5-[2-[(Cyclopropylcarbonyl)amino]-4-pyridinyl]-1-methyl-1H-pyrazole-3-carboxamide
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N-[1-(4-fluorobenzyl)-1H-pyrazol-3-yl]isonicotinamide
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1-[(1S)-2-cyano-1-cyclopropylethyl]-3-[(2-fluoro-4-pyridinyl)amino]pyrazole-4-carboxamide
CID 71534829
1-[(1R)-2-cyano-1-cyclopropylethyl]-3-[(2-fluoro-4-pyridinyl)amino]pyrazole-4-carboxamide
CID 71535123
1-(2-Cyano-1-cyclopropylethyl)-3-[(2-fluoro-4-pyridinyl)amino]pyrazole-4-carboxamide
CID 71538223
N-cyano-2-[4-[2-[(4-fluorophenyl)methyl-methylamino]ethyl]pyrazol-1-yl]pyridine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide?
The IUPAC name of N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide (CID 155688337) is N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide?
The canonical SMILES for N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide is O=C(Nc1ccn(CC2CC2)n1)c1ccncc1F.
What is the InChIKey of N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide?
The InChIKey is NCGSYNSMVFZKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c14-11-7-15-5-3-10(11)13(19)16-12-4-6-18(17-12)8-9-1-2-9/h3-7,9H,1-2,8H2,(H,16,17,19).
What are the key properties of N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide?
N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropylmethyl)pyrazol-3-yl]-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 155688337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).