3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide

C16H24N2O — CID 86987456

IUPAC3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide
SMILESCCc1ccccc1NC(=O)N1CCCC(CC)C1
InChIInChI=1S/C16H24N2O/c1-3-13-8-7-11-18(12-13)16(19)17-15-10-6-5-9-14(15)4-2/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3,(H,17,19)
InChIKeySKIYMCBZVIOTII-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.90
Rot. Bonds3

About 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide

3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide (PubChem CID 86987456) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide
PubChem CID86987456
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide
SMILESCCc1ccccc1NC(=O)N1CCCC(CC)C1
InChIInChI=1S/C16H24N2O/c1-3-13-8-7-11-18(12-13)16(19)17-15-10-6-5-9-14(15)4-2/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3,(H,17,19)
InChIKeySKIYMCBZVIOTII-UHFFFAOYSA-N
XLogP3.90
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-N-(2-bromophenyl)-3-ethylpiperidine-1-carboxamide
CID 51944008
1-[(2-ethylphenyl)carbamoyl]piperidine-3-carboxylic acid
CID 43318533
(3S)-1-[(2-ethylphenyl)carbamoyl]piperidine-3-carboxylic acid
CID 28512559
ethyl N-[3-[(3-ethylpiperidine-1-carbonyl)amino]-2-methylphenyl]carbamate
CID 87044646
(3S)-N-(2-benzylphenyl)-3-(methoxymethyl)piperidine-1-carboxamide
CID 96541051
(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone
CID 61377467
3-(hydroxymethyl)-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
CID 84529064
(3S)-3-hydroxy-N-[2-(methoxymethyl)phenyl]piperidine-1-carboxamide
CID 94081574
2-[3-[(3-ethylpiperidine-1-carbonyl)amino]phenyl]acetic acid
CID 65345636
(3R)-3-N-(2-ethylphenyl)-1-N-(4-fluorophenyl)piperidine-1,3-dicarboxamide
CID 51686700
3-ethyl-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 47177019
2-[(3-ethylpiperidine-1-carbonyl)amino]-3-methylbenzoic acid
CID 61203294

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide?
The IUPAC name of 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide (CID 86987456) is 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide is CCc1ccccc1NC(=O)N1CCCC(CC)C1.
What is the InChIKey of 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide?
The InChIKey is SKIYMCBZVIOTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-13-8-7-11-18(12-13)16(19)17-15-10-6-5-9-14(15)4-2/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3,(H,17,19).
What are the key properties of 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide?
3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 86987456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).