N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide

C19H23N3O — CID 84573709

IUPACN-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1cccc(N2CCCCC2)n1
InChIInChI=1S/C19H23N3O/c1-2-15-9-4-5-10-16(15)21-19(23)17-11-8-12-18(20-17)22-13-6-3-7-14-22/h4-5,8-12H,2-3,6-7,13-14H2,1H3,(H,21,23)
InChIKeyLGSMWOUZYGQXBS-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.89
Rot. Bonds4

About N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide

N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide (PubChem CID 84573709) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide
PubChem CID84573709
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1cccc(N2CCCCC2)n1
InChIInChI=1S/C19H23N3O/c1-2-15-9-4-5-10-16(15)21-19(23)17-11-8-12-18(20-17)22-13-6-3-7-14-22/h4-5,8-12H,2-3,6-7,13-14H2,1H3,(H,21,23)
InChIKeyLGSMWOUZYGQXBS-UHFFFAOYSA-N
XLogP3.89
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide (CID 84573709) is N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide is CCc1ccccc1NC(=O)c1cccc(N2CCCCC2)n1.
What is the InChIKey of N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The InChIKey is LGSMWOUZYGQXBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-2-15-9-4-5-10-16(15)21-19(23)17-11-8-12-18(20-17)22-13-6-3-7-14-22/h4-5,8-12H,2-3,6-7,13-14H2,1H3,(H,21,23).
What are the key properties of N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide?
N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 84573709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).