3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine

C16H31NO — CID 66351784

IUPAC3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
SMILESCCNC1CC(OCC2CCCCC2)C1(C)CC
InChIInChI=1S/C16H31NO/c1-4-16(3)14(17-5-2)11-15(16)18-12-13-9-7-6-8-10-13/h13-15,17H,4-12H2,1-3H3
InChIKeyKOFITJFUEZUPRV-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.75
Rot. Bonds6

About 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine

3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine (PubChem CID 66351784) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
PubChem CID66351784
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
SMILESCCNC1CC(OCC2CCCCC2)C1(C)CC
InChIInChI=1S/C16H31NO/c1-4-16(3)14(17-5-2)11-15(16)18-12-13-9-7-6-8-10-13/h13-15,17H,4-12H2,1-3H3
InChIKeyKOFITJFUEZUPRV-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-diethyl-2-methyl-3-(oxan-4-ylmethoxy)cyclobutan-1-amine
CID 66350254
3-(cycloheptylmethoxy)-2-ethyl-2-methylcyclobutan-1-amine
CID 114249124
3-(cycloheptylmethoxy)-2-ethyl-2-methylcyclobutan-1-ol
CID 114249116
(3-chloro-2-ethyl-2-methylcyclobutyl)oxymethylcyclohexane
CID 66344748
3-(3,3-dimethylbutoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
CID 66351618
N,2-diethyl-2-methyl-3-(2-methylbutan-2-yloxy)cyclobutan-1-amine
CID 66359047
N-cyclopentyloxy-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
CID 83229564
N-[2-(azepan-1-yl)ethyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
CID 65167643
3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine
CID 106207315
3-ethoxy-2-ethyl-2-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 65170309
3-(3,5-dimethylcyclohexyl)oxy-N,2-diethyl-2-methylcyclobutan-1-amine
CID 66350516
3-(3,4-dimethylphenoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
CID 66358932

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine?
The IUPAC name of 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine (CID 66351784) is 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine.
What is the SMILES notation for 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine?
The canonical SMILES for 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine is CCNC1CC(OCC2CCCCC2)C1(C)CC.
What is the InChIKey of 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine?
The InChIKey is KOFITJFUEZUPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-4-16(3)14(17-5-2)11-15(16)18-12-13-9-7-6-8-10-13/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine?
3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethoxy)-N,2-diethyl-2-methylcyclobutan-1-amine is sourced from PubChem (CID 66351784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).