2-(4-ethylanilino)-1-piperidin-1-ylethanone

C15H22N2O — CID 28583235

IUPAC2-(4-ethylanilino)-1-piperidin-1-ylethanone
SMILESCCc1ccc(NCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H22N2O/c1-2-13-6-8-14(9-7-13)16-12-15(18)17-10-4-3-5-11-17/h6-9,16H,2-5,10-12H2,1H3
InChIKeyOMBHEHSWKPNEBS-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.67
Rot. Bonds4

About 2-(4-ethylanilino)-1-piperidin-1-ylethanone

2-(4-ethylanilino)-1-piperidin-1-ylethanone (PubChem CID 28583235) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(4-ethylanilino)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(4-ethylanilino)-1-piperidin-1-ylethanone
PubChem CID28583235
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-(4-ethylanilino)-1-piperidin-1-ylethanone
SMILESCCc1ccc(NCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H22N2O/c1-2-13-6-8-14(9-7-13)16-12-15(18)17-10-4-3-5-11-17/h6-9,16H,2-5,10-12H2,1H3
InChIKeyOMBHEHSWKPNEBS-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(azepan-1-yl)-2-[4-(piperidine-1-carbonyl)anilino]ethanone
CID 54841440
propyl 4-[[2-(azepan-1-yl)-2-oxoethyl]amino]benzoate
CID 54812870
2-(4-ethylanilino)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone
CID 109004436
1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-ethylanilino)ethanone
CID 109004339
2-[4-(difluoromethoxy)anilino]-1-piperidin-1-ylethanone
CID 43217862
2-[4-(4-methylpiperidine-1-carbonyl)anilino]-1-piperidin-1-ylethanone
CID 54831366
2-(3,4-diaminoanilino)-1-piperidin-1-ylethanone
CID 106751115
2-(4-ethylanilino)-N-propan-2-ylacetamide
CID 28583181
1-(4-ethylphenyl)-2-(3-oxo-3-piperidin-1-ylpropyl)guanidine
CID 111054657
4-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-methyl-N-phenylbenzamide
CID 54838444
4-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836236
N-(4-ethylphenyl)azocane-1-carbothioamide
CID 2545029

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylanilino)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(4-ethylanilino)-1-piperidin-1-ylethanone (CID 28583235) is 2-(4-ethylanilino)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(4-ethylanilino)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(4-ethylanilino)-1-piperidin-1-ylethanone is CCc1ccc(NCC(=O)N2CCCCC2)cc1.
What is the InChIKey of 2-(4-ethylanilino)-1-piperidin-1-ylethanone?
The InChIKey is OMBHEHSWKPNEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-13-6-8-14(9-7-13)16-12-15(18)17-10-4-3-5-11-17/h6-9,16H,2-5,10-12H2,1H3.
What are the key properties of 2-(4-ethylanilino)-1-piperidin-1-ylethanone?
2-(4-ethylanilino)-1-piperidin-1-ylethanone has a molecular weight of 246.35 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylanilino)-1-piperidin-1-ylethanone is sourced from PubChem (CID 28583235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).