[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine

C14H26N2O — CID 66392846

IUPAC[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CC3CCC(C2)O3)CC1
InChIInChI=1S/C14H26N2O/c1-11-4-6-14(10-15,7-5-11)16-8-12-2-3-13(9-16)17-12/h11-13H,2-10,15H2,1H3
InChIKeyDQRGTBDBONSQAX-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.76
Rot. Bonds2

About [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine

[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine (PubChem CID 66392846) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
PubChem CID66392846
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CC3CCC(C2)O3)CC1
InChIInChI=1S/C14H26N2O/c1-11-4-6-14(10-15,7-5-11)16-8-12-2-3-13(9-16)17-12/h11-13H,2-10,15H2,1H3
InChIKeyDQRGTBDBONSQAX-UHFFFAOYSA-N
XLogP1.76
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine 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 [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The IUPAC name of [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine (CID 66392846) is [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine.
What is the SMILES notation for [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The canonical SMILES for [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine is CC1CCC(CN)(N2CC3CCC(C2)O3)CC1.
What is the InChIKey of [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The InChIKey is DQRGTBDBONSQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11-4-6-14(10-15,7-5-11)16-8-12-2-3-13(9-16)17-12/h11-13H,2-10,15H2,1H3.
What are the key properties of [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine has a molecular weight of 238.37 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine is sourced from PubChem (CID 66392846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).