4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide

C12H24N2O2 — CID 104551835

IUPAC4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide
SMILESCCC1(C(=O)N(C)C(C)CO)CCNCC1
InChIInChI=1S/C12H24N2O2/c1-4-12(5-7-13-8-6-12)11(16)14(3)10(2)9-15/h10,13,15H,4-9H2,1-3H3
InChIKeyDFZKIEGJPJPKGD-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.61
Rot. Bonds4

About 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide

4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide (PubChem CID 104551835) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide
PubChem CID104551835
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide
SMILESCCC1(C(=O)N(C)C(C)CO)CCNCC1
InChIInChI=1S/C12H24N2O2/c1-4-12(5-7-13-8-6-12)11(16)14(3)10(2)9-15/h10,13,15H,4-9H2,1-3H3
InChIKeyDFZKIEGJPJPKGD-UHFFFAOYSA-N
XLogP0.61
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-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

N-(1-hydroxypropan-2-yl)-N-methyl-3-propylpyrrolidine-3-carboxamide
CID 104551752
3-ethyl-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-3-carboxamide
CID 112659335
4-ethyl-N-[(2S)-1-hydroxypropan-2-yl]piperidine-4-carboxamide
CID 107218997
N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide
CID 55220524
N-[1-(dimethylamino)propan-2-yl]-4-ethylpiperidine-4-carboxamide
CID 82939518
4-ethyl-N-(5-hydroxypentyl)-N-methylpiperidine-4-carboxamide
CID 107199194
N-cyclopropyl-N,4-diethylpiperidine-4-carboxamide
CID 63127607
N-(1-bromopropan-2-yl)-1-ethyl-N-methylcyclopentane-1-carboxamide
CID 104556120
4-ethyl-N-pentyl-N-propan-2-ylpiperidine-4-carboxamide
CID 63128354
4-ethyl-N-(2-hydroxyethyl)-N-propylpiperidine-4-carboxamide
CID 63128322
methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate
CID 63128303
2-[[4-(methoxymethyl)piperidine-4-carbonyl]-methylamino]propanoic acid
CID 114042027

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide (CID 104551835) is 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide is CCC1(C(=O)N(C)C(C)CO)CCNCC1.
What is the InChIKey of 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide?
The InChIKey is DFZKIEGJPJPKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-12(5-7-13-8-6-12)11(16)14(3)10(2)9-15/h10,13,15H,4-9H2,1-3H3.
What are the key properties of 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide?
4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 104551835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).