3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide

C12H24N2O — CID 62777554

IUPAC3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
SMILESCCN(CC)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C12H24N2O/c1-4-14(5-2)12(15)10-7-6-9(3)11(13)8-10/h9-11H,4-8,13H2,1-3H3
InChIKeySTOBZZMBZJYCNT-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.62
Rot. Bonds3

About 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide

3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide (PubChem CID 62777554) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
PubChem CID62777554
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
SMILESCCN(CC)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C12H24N2O/c1-4-14(5-2)12(15)10-7-6-9(3)11(13)8-10/h9-11H,4-8,13H2,1-3H3
InChIKeySTOBZZMBZJYCNT-UHFFFAOYSA-N
XLogP1.62
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-amino-N,N-diethyl-4-methylcyclohexane-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-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
CID 62782108
3-amino-N-ethyl-N,4-dimethylcyclohexane-1-carboxamide
CID 62782994
3-amino-N-butan-2-yl-N-ethyl-4-methylcyclohexane-1-carboxamide
CID 62782504
3-amino-N-butyl-N-(2-hydroxyethyl)-4-methylcyclohexane-1-carboxamide
CID 55117107
4-amino-N-butyl-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 62781326
3-amino-N,N-diethylcyclobutane-1-carboxamide;hydrochloride
CID 165429599
3-amino-N,4-dimethyl-N-[2-oxo-2-(propylamino)ethyl]cyclohexane-1-carboxamide
CID 55116667
3-amino-N,4-dimethyl-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62776343
4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
CID 62783394
3-[ethyl(2-methylprop-2-enyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103549871
3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
CID 81074064
3-amino-N-[1-(diethylamino)propan-2-yl]-4-methylcyclohexane-1-carboxamide
CID 62781601

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide (CID 62777554) is 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide is CCN(CC)C(=O)C1CCC(C)C(N)C1.
What is the InChIKey of 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide?
The InChIKey is STOBZZMBZJYCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-14(5-2)12(15)10-7-6-9(3)11(13)8-10/h9-11H,4-8,13H2,1-3H3.
What are the key properties of 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide?
3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62777554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).