N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide

C15H29N3O — CID 115177890

IUPACN-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide
SMILESCN(CCC1CCCCC1)C(=O)C1CNCCN1C
InChIInChI=1S/C15H29N3O/c1-17-11-9-16-12-14(17)15(19)18(2)10-8-13-6-4-3-5-7-13/h13-14,16H,3-12H2,1-2H3
InChIKeyGSGVPPUNEJGOMJ-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.32
Rot. Bonds4

About N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide

N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide (PubChem CID 115177890) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide
PubChem CID115177890
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide
SMILESCN(CCC1CCCCC1)C(=O)C1CNCCN1C
InChIInChI=1S/C15H29N3O/c1-17-11-9-16-12-14(17)15(19)18(2)10-8-13-6-4-3-5-7-13/h13-14,16H,3-12H2,1-2H3
InChIKeyGSGVPPUNEJGOMJ-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-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

N,1-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]piperazine-2-carboxamide
CID 115177847
N,1-dimethyl-N-(3-methylbutyl)piperazine-2-carboxamide
CID 115177823
N-(2-cyclohexylethyl)-N-methyl-2-piperazin-1-ylacetamide
CID 115171715
N-(2-cyclopentylethyl)-N-methyl-2-pyrrolidin-3-ylacetamide
CID 115160413
N-methoxy-N,1-dimethylpiperazine-2-carboxamide
CID 58137843
3-[2-cyclohexylethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981404
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-2-pyrrolidin-3-ylacetamide
CID 115160418
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119331855
ethane;1-(1-methylpiperazin-2-yl)ethanone
CID 142036342
1-methylpiperazine-2-carboxylic acid;hydrochloride
CID 91989357
(2R,3S)-N-(2-cyclohexylethyl)-N,2-dimethylmorpholine-3-carboxamide;hydrochloride
CID 120930037
1-cyclopentyl-N-[(1-methylpiperazin-2-yl)methyl]methanamine
CID 115238393

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide?
The IUPAC name of N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide (CID 115177890) is N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide?
The canonical SMILES for N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide is CN(CCC1CCCCC1)C(=O)C1CNCCN1C.
What is the InChIKey of N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide?
The InChIKey is GSGVPPUNEJGOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-17-11-9-16-12-14(17)15(19)18(2)10-8-13-6-4-3-5-7-13/h13-14,16H,3-12H2,1-2H3.
What are the key properties of N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide?
N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-N,1-dimethylpiperazine-2-carboxamide is sourced from PubChem (CID 115177890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).