3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine

C12H25NO — CID 103037519

IUPAC3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
SMILESCOC(C)(C)CCC1CCCC(N)C1
InChIInChI=1S/C12H25NO/c1-12(2,14-3)8-7-10-5-4-6-11(13)9-10/h10-11H,4-9,13H2,1-3H3
InChIKeyNUKZGLLEDWLZOF-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.71
Rot. Bonds4

About 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine

3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine (PubChem CID 103037519) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
PubChem CID103037519
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
SMILESCOC(C)(C)CCC1CCCC(N)C1
InChIInChI=1S/C12H25NO/c1-12(2,14-3)8-7-10-5-4-6-11(13)9-10/h10-11H,4-9,13H2,1-3H3
InChIKeyNUKZGLLEDWLZOF-UHFFFAOYSA-N
XLogP2.71
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine 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-bromo-3-(3-methoxy-3-methylbutyl)cycloheptane
CID 103037607
N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine
CID 103037532
3-(3-ethoxypropyl)cyclohexan-1-amine
CID 65178011
N-[(3-aminocyclohexyl)methyl]-2-methoxy-2-methylpropanamide
CID 106123178
5-(3-methoxy-3-methylbutyl)-2-methylpiperidine
CID 106777707
ethane;3-ethylcyclohexan-1-amine
CID 164855900
1-cyclohexyl-5-methoxy-5-methylhexan-2-amine
CID 103031159
8-(3-methoxy-3-methylbutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 103034831
3-(4-methylpentyl)cyclohexan-1-amine
CID 83169215
2-(3-methoxy-3-methylbutyl)cyclohexan-1-ol
CID 103036460
3-(3-aminocyclohexyl)propanenitrile
CID 138595443
1-cyclohexyl-1-(3-methoxy-3-methylbutyl)hydrazine
CID 130242816

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine?
The IUPAC name of 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine (CID 103037519) is 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine.
What is the SMILES notation for 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine?
The canonical SMILES for 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine is COC(C)(C)CCC1CCCC(N)C1.
What is the InChIKey of 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine?
The InChIKey is NUKZGLLEDWLZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-12(2,14-3)8-7-10-5-4-6-11(13)9-10/h10-11H,4-9,13H2,1-3H3.
What are the key properties of 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine?
3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine is sourced from PubChem (CID 103037519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).