4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide

C12H24N2O2 — CID 106841954

IUPAC4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCCCO)C1
InChIInChI=1S/C12H24N2O2/c1-2-10-5-7-13-11(9-10)12(16)14-6-3-4-8-15/h10-11,13,15H,2-9H2,1H3,(H,14,16)
InChIKeyUIMNHVJAGSECQV-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.65
Rot. Bonds6

About 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide

4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide (PubChem CID 106841954) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
PubChem CID106841954
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCCCO)C1
InChIInChI=1S/C12H24N2O2/c1-2-10-5-7-13-11(9-10)12(16)14-6-3-4-8-15/h10-11,13,15H,2-9H2,1H3,(H,14,16)
InChIKeyUIMNHVJAGSECQV-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide 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

4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
7-[(4-ethylpiperidine-2-carbonyl)amino]heptanoic acid
CID 114428646
N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
CID 114428069
4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114428071
4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
CID 106147963
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 114428936
N-(2-cyclopentyloxyethyl)-4-ethylpiperidine-2-carboxamide
CID 114429058
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
4-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 114427828
4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012
4-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-2-carboxamide
CID 114429060

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide (CID 106841954) is 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NCCCCO)C1.
What is the InChIKey of 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide?
The InChIKey is UIMNHVJAGSECQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-2-10-5-7-13-11(9-10)12(16)14-6-3-4-8-15/h10-11,13,15H,2-9H2,1H3,(H,14,16).
What are the key properties of 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide?
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.65, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide is sourced from PubChem (CID 106841954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).