N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide

C16H16FN3O — CID 109223581

IUPACN-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(NCc2ccccc2F)c1
InChIInChI=1S/C16H16FN3O/c17-15-4-2-1-3-11(15)9-19-14-7-12(8-18-10-14)16(21)20-13-5-6-13/h1-4,7-8,10,13,19H,5-6,9H2,(H,20,21)
InChIKeyPIXFENRIYYAXJJ-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.72
Rot. Bonds5

About N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide

N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide (PubChem CID 109223581) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
PubChem CID109223581
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC NameN-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(NCc2ccccc2F)c1
InChIInChI=1S/C16H16FN3O/c17-15-4-2-1-3-11(15)9-19-14-7-12(8-18-10-14)16(21)20-13-5-6-13/h1-4,7-8,10,13,19H,5-6,9H2,(H,20,21)
InChIKeyPIXFENRIYYAXJJ-UHFFFAOYSA-N
XLogP2.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233439
5-[(2-fluorophenyl)methylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228022
5-[(2-fluorophenyl)methylamino]-N-prop-2-enylpyridine-3-carboxamide
CID 109223975
N-(3,5-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233459
N-(3-fluorophenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233510
5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109233450
N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109223574
1-[4-[5-[(2-fluorophenyl)methylamino]pyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 109231026
N-(2-tert-butylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233471
N-cyclopentyl-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109225985
N-(2,3-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233461
methyl 3-[[5-[(2-fluorophenyl)methylamino]pyridine-3-carbonyl]amino]benzoate
CID 109233505

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide (CID 109223581) is N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide is O=C(NC1CC1)c1cncc(NCc2ccccc2F)c1.
What is the InChIKey of N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is PIXFENRIYYAXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c17-15-4-2-1-3-11(15)9-19-14-7-12(8-18-10-14)16(21)20-13-5-6-13/h1-4,7-8,10,13,19H,5-6,9H2,(H,20,21).
What are the key properties of N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide?
N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 285.32 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109223581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).