cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone

C14H23NO2 — CID 62370931

IUPACcyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(C1CC=CCC1)N1CCCC(CCO)C1
InChIInChI=1S/C14H23NO2/c16-10-8-12-5-4-9-15(11-12)14(17)13-6-2-1-3-7-13/h1-2,12-13,16H,3-11H2
InChIKeyQIXFCTNLPAKTGO-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.96
Rot. Bonds3

About cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone

cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 62370931) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID62370931
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Namecyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(C1CC=CCC1)N1CCCC(CCO)C1
InChIInChI=1S/C14H23NO2/c16-10-8-12-5-4-9-15(11-12)14(17)13-6-2-1-3-7-13/h1-2,12-13,16H,3-11H2
InChIKeyQIXFCTNLPAKTGO-UHFFFAOYSA-N
XLogP1.96
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3R)-3-aminopiperidin-1-yl]-cyclohex-3-en-1-ylmethanone
CID 102983809
cyclohex-3-en-1-yl-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 62371831
2,3-dihydro-1H-inden-2-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 106703940
(4-aminocyclohexyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107216903
[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
CID 89469188
[3-(2-aminoethyl)piperidin-1-yl]-cyclobutylmethanone
CID 63766706
cyclopent-3-en-1-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 121200728
(3R)-3-(2-hydroxyethyl)piperidine-1-carboxylic acid
CID 69075758
cyclopent-3-en-1-yl-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 129371278
N-[[(3S)-1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]methyl]cyclopent-3-ene-1-carboxamide
CID 71853667
[3-(2-chloroethyl)piperidin-1-yl]-cyclobutylmethanone
CID 63395841
2-cyclohexyl-1-[3-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 62372498

Frequently Asked Questions

What is the IUPAC name of cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 62370931) is cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone is O=C(C1CC=CCC1)N1CCCC(CCO)C1.
What is the InChIKey of cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is QIXFCTNLPAKTGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-10-8-12-5-4-9-15(11-12)14(17)13-6-2-1-3-7-13/h1-2,12-13,16H,3-11H2.
What are the key properties of cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 237.34 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 62370931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).