N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine

C14H27NO — CID 166875846

IUPACN-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine
SMILESCOC1CCC(CN(C)C2CCCC2)CC1
InChIInChI=1S/C14H27NO/c1-15(13-5-3-4-6-13)11-12-7-9-14(16-2)10-8-12/h12-14H,3-11H2,1-2H3
InChIKeyGUQCYDWSGXJFNI-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.07
Rot. Bonds4

About N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine

N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine (PubChem CID 166875846) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine
PubChem CID166875846
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine
SMILESCOC1CCC(CN(C)C2CCCC2)CC1
InChIInChI=1S/C14H27NO/c1-15(13-5-3-4-6-13)11-12-7-9-14(16-2)10-8-12/h12-14H,3-11H2,1-2H3
InChIKeyGUQCYDWSGXJFNI-UHFFFAOYSA-N
XLogP3.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine?
The IUPAC name of N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine (CID 166875846) is N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine is COC1CCC(CN(C)C2CCCC2)CC1.
What is the InChIKey of N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine?
The InChIKey is GUQCYDWSGXJFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-15(13-5-3-4-6-13)11-12-7-9-14(16-2)10-8-12/h12-14H,3-11H2,1-2H3.
What are the key properties of N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine?
N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine has a molecular weight of 225.38 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxycyclohexyl)methyl]-N-methylcyclopentanamine is sourced from PubChem (CID 166875846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).