N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide

C12H15FN2O — CID 166088364

IUPACN-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)c1cnc(C(=O)NC2CC2)cc1F
InChIInChI=1S/C12H15FN2O/c1-7(2)9-6-14-11(5-10(9)13)12(16)15-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,15,16)
InChIKeyGAPDMXOTMXSFBJ-UHFFFAOYSA-N
MW222.26 g/mol
LogP2.24
Rot. Bonds3

About N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide

N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide (PubChem CID 166088364) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide
PubChem CID166088364
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC NameN-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)c1cnc(C(=O)NC2CC2)cc1F
InChIInChI=1S/C12H15FN2O/c1-7(2)9-6-14-11(5-10(9)13)12(16)15-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,15,16)
InChIKeyGAPDMXOTMXSFBJ-UHFFFAOYSA-N
XLogP2.24
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-6-[2,6-di(propan-2-yl)anilino]pyrimidine-4-carboxamide
CID 109339385
N-cyclopropyl-6-methylpyrimidine-4-carboxamide
CID 110848002
N-(4-methylcyclohexyl)isoquinoline-3-carboxamide
CID 22136395
5-(butan-2-ylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179836
N-cyclopropyl-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109271723
4-N,6-N-dicyclohexylpyrimidine-4,6-dicarboxamide
CID 131994880
5-bromo-N-cyclopropyl-3-fluoropyridine-2-carboxamide
CID 146026980
N-cyclopropyl-6-(2,6-difluoroanilino)pyrimidine-4-carboxamide
CID 109339410
2-N-cyclohexyl-4-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109081583
N-cyclopropyl-4-propan-2-yl-3-(trifluoromethyl)benzamide
CID 70841150
5-amino-N-(4-ethylcyclohexyl)pyrazine-2-carboxamide
CID 113381877
N-cyclobutyl-3-methyl-4-propan-2-ylbenzamide;molecular hydrogen
CID 159338969

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide (CID 166088364) is N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide is CC(C)c1cnc(C(=O)NC2CC2)cc1F.
What is the InChIKey of N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide?
The InChIKey is GAPDMXOTMXSFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c1-7(2)9-6-14-11(5-10(9)13)12(16)15-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,15,16).
What are the key properties of N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide?
N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide has a molecular weight of 222.26 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-fluoro-5-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 166088364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).