N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide

C14H19ClN2O — CID 3111956

IUPACN-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H19ClN2O/c1-2-13-5-3-4-10-17(13)14(18)16-12-8-6-11(15)7-9-12/h6-9,13H,2-5,10H2,1H3,(H,16,18)
InChIKeyBHQAQZQDBNIZAG-UHFFFAOYSA-N
MW266.77 g/mol
LogP4.14
Rot. Bonds2

About N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide

N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide (PubChem CID 3111956) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide
PubChem CID3111956
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H19ClN2O/c1-2-13-5-3-4-10-17(13)14(18)16-12-8-6-11(15)7-9-12/h6-9,13H,2-5,10H2,1H3,(H,16,18)
InChIKeyBHQAQZQDBNIZAG-UHFFFAOYSA-N
XLogP4.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-ethyl-N-phenylpiperidine-1-carboxamide
CID 728630
(2R)-N-(4-chlorophenyl)-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 40622393
4-[[(2S)-2-ethylpiperidine-1-carbonyl]amino]benzenesulfonyl chloride
CID 97291407
N-[4-(aminomethyl)phenyl]-2-ethylazepane-1-carboxamide
CID 104690862
(2R)-2-ethyl-N-[3-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]phenyl]piperidine-1-carboxamide
CID 7190614
2-ethyl-N-[4-(4-methylpiperidin-1-yl)phenyl]piperidine-1-carboxamide
CID 108990903
N-(4-chloro-2-methylphenyl)-2-ethylpiperidine-1-carboxamide
CID 108990888
N-(2,6-dichlorophenyl)-2-ethylpiperidine-1-carboxamide
CID 108990919
5-[(2-ethylazepane-1-carbonyl)amino]pyridine-2-carboxylic acid
CID 104690906
N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
CID 108990928
4-chloro-N-(2-ethylpiperidine-1-carbothioyl)benzamide
CID 2909948
4-[(2-ethylpyrrolidine-1-carbonyl)amino]-2-hydroxybenzoic acid
CID 61207094

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide (CID 3111956) is N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide is CCC1CCCCN1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide?
The InChIKey is BHQAQZQDBNIZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-2-13-5-3-4-10-17(13)14(18)16-12-8-6-11(15)7-9-12/h6-9,13H,2-5,10H2,1H3,(H,16,18).
What are the key properties of N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide?
N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide has a molecular weight of 266.77 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide is sourced from PubChem (CID 3111956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).