2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride

C12H25ClN2O — CID 119783122

IUPAC2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
SMILESCNCC(=O)NCCC1CCCC(C)C1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-10-4-3-5-11(8-10)6-7-14-12(15)9-13-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H
InChIKeyWBPNELKZUYFDPK-UHFFFAOYSA-N
MW248.80 g/mol
LogP1.96
Rot. Bonds5

About 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride

2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride (PubChem CID 119783122) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
PubChem CID119783122
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
SMILESCNCC(=O)NCCC1CCCC(C)C1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-10-4-3-5-11(8-10)6-7-14-12(15)9-13-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H
InChIKeyWBPNELKZUYFDPK-UHFFFAOYSA-N
XLogP1.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride 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

2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide
CID 78966290
2-hydroxy-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 103430075
(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 78966012
(2S)-2-amino-3-methyl-N-[2-(3-methylcyclohexyl)ethyl]butanamide;hydrochloride
CID 119323315
1-methoxy-3-[2-[(1S,3S)-3-methylcyclohexyl]ethyl]urea
CID 95628739
3-bromo-N-[2-(3-methylcyclohexyl)ethyl]prop-2-ynamide
CID 130918142
2-(methylamino)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115152043
4-(methylamino)-N-[(3-methylcyclohexyl)methyl]butanamide;hydrochloride
CID 119750255
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
CID 115629689
N-[2-(3-methylcyclohexyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119323298
2-amino-N-[2-(3-methylcyclohexyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120793045
(2R,5S)-5-[2-(3-methylcyclohexyl)ethylcarbamoyl]oxolane-2-carboxylic acid
CID 102945305

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride (CID 119783122) is 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride is CNCC(=O)NCCC1CCCC(C)C1.Cl.
What is the InChIKey of 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride?
The InChIKey is WBPNELKZUYFDPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-10-4-3-5-11(8-10)6-7-14-12(15)9-13-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H.
What are the key properties of 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride?
2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119783122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).