3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide

C14H13FN6O — CID 167941298

IUPAC3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide
SMILESCn1ccnc1-c1cc(NC(=O)c2ncccc2F)n(C)n1
InChIInChI=1S/C14H13FN6O/c1-20-7-6-17-13(20)10-8-11(21(2)19-10)18-14(22)12-9(15)4-3-5-16-12/h3-8H,1-2H3,(H,18,22)
InChIKeyJBKVVUMVGBWTNO-UHFFFAOYSA-N
MW300.30 g/mol
LogP1.61
Rot. Bonds3

About 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide

3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide (PubChem CID 167941298) has the molecular formula C14H13FN6O and a molecular weight of 300.30 g/mol. Its IUPAC name is 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide
PubChem CID167941298
Molecular FormulaC14H13FN6O
Molecular Weight300.30 g/mol
Exact Mass300.11
IUPAC Name3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide
SMILESCn1ccnc1-c1cc(NC(=O)c2ncccc2F)n(C)n1
InChIInChI=1S/C14H13FN6O/c1-20-7-6-17-13(20)10-8-11(21(2)19-10)18-14(22)12-9(15)4-3-5-16-12/h3-8H,1-2H3,(H,18,22)
InChIKeyJBKVVUMVGBWTNO-UHFFFAOYSA-N
XLogP1.61
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.30
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2,5-dicarboxamide
CID 99638300
3-fluoro-N-(5-methyl-1H-pyrazol-3-yl)pyridine-2-carboxamide
CID 110474752
N-(2,5-dimethylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474800
N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]-2-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 127595040
3-fluoro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-2-carboxamide
CID 110474855
N-(3-chloro-4-methylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474858
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-3-fluoropyridine-2-carboxamide
CID 166327066
N-(3-chloro-2-methylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474859
2-bromo-N-(2,5-dimethylpyrazol-3-yl)-6-fluorobenzamide
CID 115678351
N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1H-indazole-3-carboxamide
CID 29182775
N-(2,5-dimethylpyrazol-3-yl)-2,3-difluorobenzamide
CID 62650484
N-[3-(4-aminophenyl)-1-methylpyrazol-5-yl]-2-fluorobenzamide
CID 170346210

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide (CID 167941298) is 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide is Cn1ccnc1-c1cc(NC(=O)c2ncccc2F)n(C)n1.
What is the InChIKey of 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide?
The InChIKey is JBKVVUMVGBWTNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN6O/c1-20-7-6-17-13(20)10-8-11(21(2)19-10)18-14(22)12-9(15)4-3-5-16-12/h3-8H,1-2H3,(H,18,22).
What are the key properties of 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide?
3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide has a molecular weight of 300.30 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2-carboxamide is sourced from PubChem (CID 167941298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).