N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide

C19H22N2O — CID 86927162

IUPACN-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide
SMILESO=C(c1ccccn1)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C19H22N2O/c22-19(18-12-6-7-14-20-18)21(17-10-4-5-11-17)15-13-16-8-2-1-3-9-16/h1-3,6-9,12,14,17H,4-5,10-11,13,15H2
InChIKeyZJCWLBKOTKHMFK-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.71
Rot. Bonds5

About N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide

N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide (PubChem CID 86927162) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide
PubChem CID86927162
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide
SMILESO=C(c1ccccn1)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C19H22N2O/c22-19(18-12-6-7-14-20-18)21(17-10-4-5-11-17)15-13-16-8-2-1-3-9-16/h1-3,6-9,12,14,17H,4-5,10-11,13,15H2
InChIKeyZJCWLBKOTKHMFK-UHFFFAOYSA-N
XLogP3.71
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide (CID 86927162) is N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide is O=C(c1ccccn1)N(CCc1ccccc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide?
The InChIKey is ZJCWLBKOTKHMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c22-19(18-12-6-7-14-20-18)21(17-10-4-5-11-17)15-13-16-8-2-1-3-9-16/h1-3,6-9,12,14,17H,4-5,10-11,13,15H2.
What are the key properties of N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide?
N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 86927162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).