2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine

C13H25NO — CID 114543810

IUPAC2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine
SMILESCCC1CC(NC2CCC(C)C2)CCO1
InChIInChI=1S/C13H25NO/c1-3-13-9-12(6-7-15-13)14-11-5-4-10(2)8-11/h10-14H,3-9H2,1-2H3
InChIKeyDOMMADCYRLOUOW-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.72
Rot. Bonds3

About 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine

2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine (PubChem CID 114543810) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine.

Molecular Properties

Compound Name2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine
PubChem CID114543810
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine
SMILESCCC1CC(NC2CCC(C)C2)CCO1
InChIInChI=1S/C13H25NO/c1-3-13-9-12(6-7-15-13)14-11-5-4-10(2)8-11/h10-14H,3-9H2,1-2H3
InChIKeyDOMMADCYRLOUOW-UHFFFAOYSA-N
XLogP2.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-Methoxycyclopentyl)morpholine
CID 119031214
2-propan-2-yl-N-(3,3,3-trifluoropropyl)oxan-4-amine
CID 64102696
2-propan-2-yl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 64106491
2,2-diethyl-N-(3-fluoropropyl)oxan-4-amine
CID 83032749
2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine
CID 83032755
2-propan-2-yl-N-(4,4,4-trifluorobutan-2-yl)oxan-4-amine
CID 113348149
N-[(3,3-difluorocyclopentyl)methyl]-2-(oxan-2-yl)ethanamine
CID 114223993
2,2-diethyl-N-(5-fluoropentyl)oxan-4-amine
CID 114280230
N-(2,2-difluoroethyl)-2-propan-2-yloxan-4-amine
CID 115406058
2-propan-2-yl-N-(4,4,4-trifluorobutyl)oxan-4-amine
CID 115516555
2-propan-2-yl-N-(5,5,5-trifluoropentyl)oxan-4-amine
CID 115517490
2,2,6-Trimethyl-4-(8-methyloctadecoxy)piperidine
CID 17902157

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine?
The IUPAC name of 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine (CID 114543810) is 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine.
What is the SMILES notation for 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine?
The canonical SMILES for 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine is CCC1CC(NC2CCC(C)C2)CCO1.
What is the InChIKey of 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine?
The InChIKey is DOMMADCYRLOUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-3-13-9-12(6-7-15-13)14-11-5-4-10(2)8-11/h10-14H,3-9H2,1-2H3.
What are the key properties of 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine?
2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine has a molecular weight of 211.35 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine is sourced from PubChem (CID 114543810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).