N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide

C13H26N2O — CID 79195699

IUPACN-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCCC1CCCCC1
InChIInChI=1S/C13H26N2O/c1-11(10-14-2)13(16)15-9-8-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyAVGLRULODATSEC-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.93
Rot. Bonds6

About N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide

N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide (PubChem CID 79195699) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
PubChem CID79195699
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCCC1CCCCC1
InChIInChI=1S/C13H26N2O/c1-11(10-14-2)13(16)15-9-8-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyAVGLRULODATSEC-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide 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-(2-cyclohexylethyl)-3-(ethylamino)-2-methylpropanamide
CID 62853087
N-(2-cyclopentylethyl)-2-(methylaminomethyl)butanamide
CID 115188971
N-(4-cyclohexylbutan-2-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119791225
N-(cyclobutylmethyl)-2-methyl-3-(methylamino)propanamide
CID 79196076
(2R)-2-amino-N-(2-cyclohexylethyl)-3-methylbutanamide
CID 79012516
N-(2-cyclopentylethyl)-2-methoxypropanamide
CID 115588216
3-(2-cyclohexylethylamino)-2-(methylamino)-3-oxopropanoic acid
CID 115189528
2-(2-cyclohexylethylcarbamoyl)-3-methylbutanoic acid
CID 115186283
N-cyclohexyl-2-methyl-3-(methylamino)propanamide
CID 79195893
(2S)-2-amino-N-(2-cyclobutylethyl)propanamide
CID 103797223
N-cycloheptyl-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674669
(2S)-2-amino-N-(2-cyclohexylethyl)-3-hydroxypropanamide
CID 70364930

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide (CID 79195699) is N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide?
The InChIKey is AVGLRULODATSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11(10-14-2)13(16)15-9-8-12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide?
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide has a molecular weight of 226.36 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 79195699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).