1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide

C12H24N2O2 — CID 63008768

IUPAC1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide
SMILESCOCCCN(C)C(=O)C1(N)CCCCC1
InChIInChI=1S/C12H24N2O2/c1-14(9-6-10-16-2)11(15)12(13)7-4-3-5-8-12/h3-10,13H2,1-2H3
InChIKeyUKDQOZKMZLYXPN-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.14
Rot. Bonds5

About 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide

1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide (PubChem CID 63008768) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide
PubChem CID63008768
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide
SMILESCOCCCN(C)C(=O)C1(N)CCCCC1
InChIInChI=1S/C12H24N2O2/c1-14(9-6-10-16-2)11(15)12(13)7-4-3-5-8-12/h3-10,13H2,1-2H3
InChIKeyUKDQOZKMZLYXPN-UHFFFAOYSA-N
XLogP1.14
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-amino-N-(3-methoxypropyl)-N-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

1-amino-N,N-bis(2-methoxyethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262683
methyl 4-[(1-aminocyclobutanecarbonyl)-methylamino]butanoate
CID 81172837
1-[3-methoxypropyl(methyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 62985662
1-cyano-N-(3-methoxypropyl)-N-methylcyclopropane-1-carboxamide
CID 80592807
1-amino-N-methyl-N-pent-4-enylcyclopentane-1-carboxamide
CID 115734605
1-amino-N-[3-(dimethylamino)propyl]-N-methylcyclopropane-1-carboxamide
CID 65458413
N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 63142401
1-amino-N-[3-(4-chlorophenoxy)propyl]-N-methylcyclopropane-1-carboxamide;hydrochloride
CID 119739903
1-amino-N-(2-cyanoethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 63286552
1-amino-N-[2-(4-methoxyphenoxy)ethyl]-N-methylcyclobutane-1-carboxamide
CID 81173078
1-amino-N-[2-(4-bromophenoxy)ethyl]-N-methylcyclopentane-1-carboxamide
CID 60937922
1-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 54872120

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide (CID 63008768) is 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide is COCCCN(C)C(=O)C1(N)CCCCC1.
What is the InChIKey of 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide?
The InChIKey is UKDQOZKMZLYXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-14(9-6-10-16-2)11(15)12(13)7-4-3-5-8-12/h3-10,13H2,1-2H3.
What are the key properties of 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide?
1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 63008768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).