2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine

C14H29NO — CID 139968893

IUPAC2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine
SMILESCCNCC(COC)(C(C)C)C1CCCC1
InChIInChI=1S/C14H29NO/c1-5-15-10-14(11-16-4,12(2)3)13-8-6-7-9-13/h12-13,15H,5-11H2,1-4H3
InChIKeyWVGSDUHPSOCWRJ-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.07
Rot. Bonds7

About 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine

2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine (PubChem CID 139968893) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine
PubChem CID139968893
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine
SMILESCCNCC(COC)(C(C)C)C1CCCC1
InChIInChI=1S/C14H29NO/c1-5-15-10-14(11-16-4,12(2)3)13-8-6-7-9-13/h12-13,15H,5-11H2,1-4H3
InChIKeyWVGSDUHPSOCWRJ-UHFFFAOYSA-N
XLogP3.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-2-(methoxymethyl)-3-methylbutan-1-amine
CID 139927528
[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane
CID 90169995
N-ethyl-2-(methoxymethyl)-3,3-dimethyl-2-propan-2-ylbutan-1-amine
CID 139968987
methyl 2-cyclohexyl-2-(methoxymethyl)-3-methylbutanoate
CID 66831106
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
CID 89106500
2-cyclopentyl-2-(methoxymethyl)-3-methylbutanoic acid
CID 23202697
(2-cyclohexyl-1,3-dimethoxybutan-2-yl)cyclohexane
CID 66896613
2-cyclopentyl-2-(methoxymethyl)-N,3,3-trimethylbutan-1-amine
CID 139968980
2-cyclopentyl-2-(methoxymethyl)-4-methylpentan-1-amine
CID 139968950
2-cyclopentyl-2-(methoxymethyl)butan-1-amine
CID 139927552
2-cycloheptyloxy-N-ethyl-2-methylpropan-1-amine
CID 62354223
N-ethyl-2-(2-methoxyethyl)-2,3-dimethylbutan-1-amine
CID 83159390

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine?
The IUPAC name of 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine (CID 139968893) is 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine.
What is the SMILES notation for 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine?
The canonical SMILES for 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine is CCNCC(COC)(C(C)C)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine?
The InChIKey is WVGSDUHPSOCWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-5-15-10-14(11-16-4,12(2)3)13-8-6-7-9-13/h12-13,15H,5-11H2,1-4H3.
What are the key properties of 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine?
2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine is sourced from PubChem (CID 139968893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).