N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine

C16H31NO — CID 64753172

IUPACN,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
SMILESCNC1CC(C)CC(C)C1OC1CCCC(C)C1
InChIInChI=1S/C16H31NO/c1-11-6-5-7-14(9-11)18-16-13(3)8-12(2)10-15(16)17-4/h11-17H,5-10H2,1-4H3
InChIKeyMYKCTELWUKXTIT-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.60
Rot. Bonds3

About N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine

N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine (PubChem CID 64753172) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine.

Molecular Properties

Compound NameN,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
PubChem CID64753172
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC NameN,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
SMILESCNC1CC(C)CC(C)C1OC1CCCC(C)C1
InChIInChI=1S/C16H31NO/c1-11-6-5-7-14(9-11)18-16-13(3)8-12(2)10-15(16)17-4/h11-17H,5-10H2,1-4H3
InChIKeyMYKCTELWUKXTIT-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
CID 55209037
2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64752392
2-cyclobutyloxy-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64752391
N,3-dimethylcyclohexan-1-amine
CID 16771259
2-(3,5-dimethylcyclohexyl)oxy-N-methylcyclohexan-1-amine
CID 64728780
N,3-dimethylcyclohexan-1-amine;hydrochloride
CID 45286057
2-heptoxy-N,3,5-trimethylcyclohexan-1-amine
CID 64752776
1-(2-iodocyclopentyl)oxy-3-methylcyclohexane
CID 114773596
N-ethyl-2-(3-methylcyclohexyl)oxycyclooctan-1-amine
CID 63474385
2-(3-methylcyclohexyl)oxy-4-azatricyclo[4.2.1.03,7]nonane
CID 112747579
2-(3-methoxypropoxy)-N,3,5-trimethylcyclohexan-1-amine
CID 64751601
N,3,5-trimethyl-2-pentoxycyclohexan-1-amine
CID 64753575

Frequently Asked Questions

What is the IUPAC name of N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The IUPAC name of N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine (CID 64753172) is N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine.
What is the SMILES notation for N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The canonical SMILES for N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine is CNC1CC(C)CC(C)C1OC1CCCC(C)C1.
What is the InChIKey of N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
The InChIKey is MYKCTELWUKXTIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-11-6-5-7-14(9-11)18-16-13(3)8-12(2)10-15(16)17-4/h11-17H,5-10H2,1-4H3.
What are the key properties of N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine?
N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine is sourced from PubChem (CID 64753172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).