2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine

C14H27NO — CID 64752392

IUPAC2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1OC1CCC1
InChIInChI=1S/C14H27NO/c1-4-15-13-9-10(2)8-11(3)14(13)16-12-6-5-7-12/h10-15H,4-9H2,1-3H3
InChIKeyVQPMWTCJPLPEDR-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds4

About 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine

2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine (PubChem CID 64752392) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
PubChem CID64752392
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1OC1CCC1
InChIInChI=1S/C14H27NO/c1-4-15-13-9-10(2)8-11(3)14(13)16-12-6-5-7-12/h10-15H,4-9H2,1-3H3
InChIKeyVQPMWTCJPLPEDR-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyloxy-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64752391
N-ethyl-3,5-dimethyl-2-(oxetan-3-yloxy)cyclohexan-1-amine
CID 102606113
2-ethoxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64751781
N,3,5-trimethyl-2-(3-methylcyclohexyl)oxycyclohexan-1-amine
CID 64753172
N-ethyl-3,5-dimethyl-2-propoxycyclohexan-1-amine
CID 64753175
N-ethyl-2-hexoxy-3,5-dimethylcyclohexan-1-amine
CID 64752582
2-(3,3-dimethylbutoxy)-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 66234496
N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3,5-dimethylcyclohexan-1-amine
CID 102721859
N-ethyl-2-(3-methylcyclohexyl)oxycyclooctan-1-amine
CID 63474385
N-ethyl-3,5-dimethyl-2-(4-methylpentoxy)cyclohexan-1-amine
CID 64751794
N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine
CID 64722404
2-cyclobutyloxy-N,4-diethylcyclohexan-1-amine
CID 62141386

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine (CID 64752392) is 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine is CCNC1CC(C)CC(C)C1OC1CCC1.
What is the InChIKey of 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine?
The InChIKey is VQPMWTCJPLPEDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-15-13-9-10(2)8-11(3)14(13)16-12-6-5-7-12/h10-15H,4-9H2,1-3H3.
What are the key properties of 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine?
2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 64752392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).