N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide

C18H20N2O — CID 84510606

IUPACN-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide
SMILESO=C(NCCC(c1ccccc1)C1CC1)c1cccnc1
InChIInChI=1S/C18H20N2O/c21-18(16-7-4-11-19-13-16)20-12-10-17(15-8-9-15)14-5-2-1-3-6-14/h1-7,11,13,15,17H,8-10,12H2,(H,20,21)
InChIKeyRYFXPQOYUWIZQE-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.40
Rot. Bonds6

About N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide

N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide (PubChem CID 84510606) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide
PubChem CID84510606
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide
SMILESO=C(NCCC(c1ccccc1)C1CC1)c1cccnc1
InChIInChI=1S/C18H20N2O/c21-18(16-7-4-11-19-13-16)20-12-10-17(15-8-9-15)14-5-2-1-3-6-14/h1-7,11,13,15,17H,8-10,12H2,(H,20,21)
InChIKeyRYFXPQOYUWIZQE-UHFFFAOYSA-N
XLogP3.40
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-phenylpropyl)pyridine-3-carboxamide
CID 46446505
triphenyl-[5-(pyridine-3-carbonylamino)pentyl]phosphanium
CID 169012759
N-[2-[(2-benzhydryloxyacetyl)amino]ethyl]pyridine-3-carboxamide
CID 39577664
N-[2-(cyclopentylamino)ethyl]pyridine-3-carboxamide
CID 3267981
N-[(2S)-2-cyclopentyl-2-phenylethyl]-2-pyridin-3-ylacetamide
CID 95213041
N-[2-[[(3R,4R)-3,4-dimethylpiperidine-1-carbonyl]amino]ethyl]pyridine-3-carboxamide
CID 124595352
2-(pyridine-3-carbonylamino)ethyl 2-phenylbutanoate
CID 69106862
N-benzylpyridine-3-carboxamide chloride
CID 21204170
N-[3-(cyclopentanecarbonylamino)propyl]pyridine-3-carboxamide
CID 108926695
N-[2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
CID 4235481
potassium 3-(pyridine-3-carbonylamino)propane-1-sulfonate
CID 25072807
N-(3-bromo-4-methoxybutyl)pyridine-3-carboxamide
CID 106244946

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide?
The IUPAC name of N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide (CID 84510606) is N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide is O=C(NCCC(c1ccccc1)C1CC1)c1cccnc1.
What is the InChIKey of N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide?
The InChIKey is RYFXPQOYUWIZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-18(16-7-4-11-19-13-16)20-12-10-17(15-8-9-15)14-5-2-1-3-6-14/h1-7,11,13,15,17H,8-10,12H2,(H,20,21).
What are the key properties of N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide?
N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropyl-3-phenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 84510606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).