4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide

C18H34N4O2 — CID 94097241

IUPAC4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide
SMILESCN(C)[C@H](CNC(=O)N1CCC(CC(N)=O)CC1)C1CCCCC1
InChIInChI=1S/C18H34N4O2/c1-21(2)16(15-6-4-3-5-7-15)13-20-18(24)22-10-8-14(9-11-22)12-17(19)23/h14-16H,3-13H2,1-2H3,(H2,19,23)(H,20,24)/t16-/m1/s1
InChIKeyBKFZNEBUJKFLBR-MRXNPFEDSA-N
MW338.50 g/mol
LogP1.79
Rot. Bonds6

About 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide

4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide (PubChem CID 94097241) has the molecular formula C18H34N4O2 and a molecular weight of 338.50 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide
PubChem CID94097241
Molecular FormulaC18H34N4O2
Molecular Weight338.50 g/mol
Exact Mass338.27
IUPAC Name4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide
SMILESCN(C)[C@H](CNC(=O)N1CCC(CC(N)=O)CC1)C1CCCCC1
InChIInChI=1S/C18H34N4O2/c1-21(2)16(15-6-4-3-5-7-15)13-20-18(24)22-10-8-14(9-11-22)12-17(19)23/h14-16H,3-13H2,1-2H3,(H2,19,23)(H,20,24)/t16-/m1/s1
InChIKeyBKFZNEBUJKFLBR-MRXNPFEDSA-N
XLogP1.79
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-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

3-[[4-(2-amino-2-oxoethyl)piperidine-1-carbonyl]amino]-2-methylpropanoic acid
CID 62669034
(2S)-3-[[4-(2-amino-2-oxoethyl)piperidine-1-carbonyl]amino]-2-hydroxypropanoic acid
CID 114007350
2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide
CID 119850519
4-(2-amino-2-oxoethyl)-N-cyclopropylpiperidine-1-carboxamide
CID 86811914
(2S)-2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-3-methylbutanamide
CID 119850509
2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]pentanamide;dihydrochloride
CID 119850478
4-(2-amino-2-oxoethyl)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]piperidine-1-carboxamide
CID 95589080
N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]-2-methoxyacetamide
CID 94119176
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide
CID 119850513
2-[[4-(2-amino-2-oxoethyl)piperidine-1-carbonyl]amino]-2-cyclopropylacetic acid
CID 62710378
N-[2-cyclohexyl-2-(dimethylamino)ethyl]-N'-methyl-4-(oxolane-2-carbonyl)piperazine-1-carboximidamide;hydroiodide
CID 111302418
2-cyclodecylacetamide
CID 150110792

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide (CID 94097241) is 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide is CN(C)[C@H](CNC(=O)N1CCC(CC(N)=O)CC1)C1CCCCC1.
What is the InChIKey of 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is BKFZNEBUJKFLBR-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H34N4O2/c1-21(2)16(15-6-4-3-5-7-15)13-20-18(24)22-10-8-14(9-11-22)12-17(19)23/h14-16H,3-13H2,1-2H3,(H2,19,23)(H,20,24)/t16-/m1/s1.
What are the key properties of 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide?
4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 338.50 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethyl)-N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 94097241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).