N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine

C14H27NO — CID 55209037

IUPACN-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
SMILESCNC1CCCCC1OC1CCCC(C)C1
InChIInChI=1S/C14H27NO/c1-11-6-5-7-12(10-11)16-14-9-4-3-8-13(14)15-2/h11-15H,3-10H2,1-2H3
InChIKeyONEPGMGEADHZQW-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.11
Rot. Bonds3

About N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine

N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine (PubChem CID 55209037) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
PubChem CID55209037
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
SMILESCNC1CCCCC1OC1CCCC(C)C1
InChIInChI=1S/C14H27NO/c1-11-6-5-7-12(10-11)16-14-9-4-3-8-13(14)15-2/h11-15H,3-10H2,1-2H3
InChIKeyONEPGMGEADHZQW-UHFFFAOYSA-N
XLogP3.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The IUPAC name of N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine (CID 55209037) is N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The canonical SMILES for N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine is CNC1CCCCC1OC1CCCC(C)C1.
What is the InChIKey of N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The InChIKey is ONEPGMGEADHZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11-6-5-7-12(10-11)16-14-9-4-3-8-13(14)15-2/h11-15H,3-10H2,1-2H3.
What are the key properties of N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine is sourced from PubChem (CID 55209037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).