3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide

C17H33N3O — CID 62782861

IUPAC3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
SMILESCCN1CCC(N(C)C(=O)CCC2CCC(N)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-3-20-12-10-16(11-13-20)19(2)17(21)9-6-14-4-7-15(18)8-5-14/h14-16H,3-13,18H2,1-2H3
InChIKeyNGSPZGUYXMVVLD-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.23
Rot. Bonds5

About 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide

3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide (PubChem CID 62782861) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide.

Molecular Properties

Compound Name3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
PubChem CID62782861
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC Name3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
SMILESCCN1CCC(N(C)C(=O)CCC2CCC(N)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-3-20-12-10-16(11-13-20)19(2)17(21)9-6-14-4-7-15(18)8-5-14/h14-16H,3-13,18H2,1-2H3
InChIKeyNGSPZGUYXMVVLD-UHFFFAOYSA-N
XLogP2.23
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide 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-(4-aminocyclohexyl)-3-cyclobutyl-N-methylpropanamide
CID 115277537
4-[(1-ethylpiperidin-4-yl)-methylamino]-4-oxobutanoic acid
CID 43578327
N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
CID 60724468
3-(4-aminocyclohexyl)-1-(4-ethylpiperazin-1-yl)propan-1-one
CID 55116653
N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
CID 79192601
3-cyclopropyl-N-methyl-N-piperidin-4-ylpropanamide
CID 119441464
N-cyclohexyl-3-cyclopentyl-N-methylpropanamide
CID 86976959
3-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropanamide
CID 116817268
N-(4-aminocyclohexyl)-N-methyloctanamide
CID 79121707
5-[(1-ethylpiperidin-4-yl)-methylamino]-3,3-dimethyl-5-oxopentanoic acid
CID 62934557
4-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylcyclohexane-1-carboxamide
CID 62808188
2-amino-N-(1-ethylpiperidin-4-yl)-N-methylcyclopentane-1-carboxamide
CID 64822922

Frequently Asked Questions

What is the IUPAC name of 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide?
The IUPAC name of 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide (CID 62782861) is 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide.
What is the SMILES notation for 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide?
The canonical SMILES for 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide is CCN1CCC(N(C)C(=O)CCC2CCC(N)CC2)CC1.
What is the InChIKey of 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide?
The InChIKey is NGSPZGUYXMVVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-3-20-12-10-16(11-13-20)19(2)17(21)9-6-14-4-7-15(18)8-5-14/h14-16H,3-13,18H2,1-2H3.
What are the key properties of 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide?
3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide has a molecular weight of 295.47 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide is sourced from PubChem (CID 62782861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).