3-(cyclohexylmethoxy)-N-methylheptan-4-amine

C15H31NO — CID 55066438

IUPAC3-(cyclohexylmethoxy)-N-methylheptan-4-amine
SMILESCCCC(NC)C(CC)OCC1CCCCC1
InChIInChI=1S/C15H31NO/c1-4-9-14(16-3)15(5-2)17-12-13-10-7-6-8-11-13/h13-16H,4-12H2,1-3H3
InChIKeyZCDYNXFEOKWRKB-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.75
Rot. Bonds8

About 3-(cyclohexylmethoxy)-N-methylheptan-4-amine

3-(cyclohexylmethoxy)-N-methylheptan-4-amine (PubChem CID 55066438) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 3-(cyclohexylmethoxy)-N-methylheptan-4-amine.

Molecular Properties

Compound Name3-(cyclohexylmethoxy)-N-methylheptan-4-amine
PubChem CID55066438
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name3-(cyclohexylmethoxy)-N-methylheptan-4-amine
SMILESCCCC(NC)C(CC)OCC1CCCCC1
InChIInChI=1S/C15H31NO/c1-4-9-14(16-3)15(5-2)17-12-13-10-7-6-8-11-13/h13-16H,4-12H2,1-3H3
InChIKeyZCDYNXFEOKWRKB-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(cyclohexylmethoxy)-N-methylheptan-4-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

3-cyclobutyloxy-N-methylheptan-4-amine
CID 62115090
1-cyclopentyl-3-methoxy-N-methylhexan-2-amine
CID 116718854
1-cycloheptyl-N,3-dimethylhexan-2-amine
CID 107893929
3-(cyclohexylmethoxy)-N-ethylbutan-1-amine
CID 114999307
1-methoxypropoxymethylcyclohexane
CID 20748230
2-(cycloheptylmethoxy)-N-methylpropan-1-amine
CID 165349469
3-(2-cyclobutylethoxy)-N-propylheptan-4-amine
CID 106201007
N-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]heptan-4-amine
CID 112587366
4-(cyclohexylmethoxy)-N-ethylpentan-1-amine
CID 62485288
1-(cyclohexylmethoxy)propan-1-amine
CID 123186405
3-cyclohexyl-1,1-difluoro-N-methylpropan-2-amine
CID 80604795
1-cyclohexyl-3-ethoxy-N-ethylpentan-2-amine
CID 116717017

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethoxy)-N-methylheptan-4-amine?
The IUPAC name of 3-(cyclohexylmethoxy)-N-methylheptan-4-amine (CID 55066438) is 3-(cyclohexylmethoxy)-N-methylheptan-4-amine.
What is the SMILES notation for 3-(cyclohexylmethoxy)-N-methylheptan-4-amine?
The canonical SMILES for 3-(cyclohexylmethoxy)-N-methylheptan-4-amine is CCCC(NC)C(CC)OCC1CCCCC1.
What is the InChIKey of 3-(cyclohexylmethoxy)-N-methylheptan-4-amine?
The InChIKey is ZCDYNXFEOKWRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-4-9-14(16-3)15(5-2)17-12-13-10-7-6-8-11-13/h13-16H,4-12H2,1-3H3.
What are the key properties of 3-(cyclohexylmethoxy)-N-methylheptan-4-amine?
3-(cyclohexylmethoxy)-N-methylheptan-4-amine has a molecular weight of 241.42 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethoxy)-N-methylheptan-4-amine is sourced from PubChem (CID 55066438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).