3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine

C15H28N2O — CID 66372208

IUPAC3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCN2CC3CCC(C2)O3)C1
InChIInChI=1S/C15H28N2O/c1-12-3-2-4-13(9-12)16-7-8-17-10-14-5-6-15(11-17)18-14/h12-16H,2-11H2,1H3
InChIKeyUQAUCHBBYWHECD-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.02
Rot. Bonds4

About 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine

3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine (PubChem CID 66372208) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine
PubChem CID66372208
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCN2CC3CCC(C2)O3)C1
InChIInChI=1S/C15H28N2O/c1-12-3-2-4-13(9-12)16-7-8-17-10-14-5-6-15(11-17)18-14/h12-16H,2-11H2,1H3
InChIKeyUQAUCHBBYWHECD-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine with MolForge

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Related Compounds

N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclopentanamine
CID 66369856
3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 60701471
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 55024069
3-methyl-N-[2-(4-propylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 62573742
N-[2-(3,4-dimethylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 63620169
N,N-dimethyl-1-[2-[(3-methylcyclohexyl)amino]ethyl]pyrrolidin-3-amine
CID 63167443
3-methyl-N-[2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)ethyl]cyclohexan-1-amine
CID 79170964
N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 62561082
N-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-3-methylcyclohexan-1-amine
CID 63979129
3-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 64501657
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]cycloheptanamine
CID 55024032
cis-(1R,3S)-3-methyl-N-propylcyclohexan-1-amine
CID 15350394

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine (CID 66372208) is 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine is CC1CCCC(NCCN2CC3CCC(C2)O3)C1.
What is the InChIKey of 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine?
The InChIKey is UQAUCHBBYWHECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-12-3-2-4-13(9-12)16-7-8-17-10-14-5-6-15(11-17)18-14/h12-16H,2-11H2,1H3.
What are the key properties of 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine?
3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine has a molecular weight of 252.40 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 66372208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).