2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine

C12H23NO — CID 54856689

IUPAC2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
SMILESC1CCC(CCNCC2CCCO2)C1
InChIInChI=1S/C12H23NO/c1-2-5-11(4-1)7-8-13-10-12-6-3-9-14-12/h11-13H,1-10H2
InChIKeyUDFQHPCZZDWAKX-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.34
Rot. Bonds5

About 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine

2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine (PubChem CID 54856689) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
PubChem CID54856689
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine
SMILESC1CCC(CCNCC2CCCO2)C1
InChIInChI=1S/C12H23NO/c1-2-5-11(4-1)7-8-13-10-12-6-3-9-14-12/h11-13H,1-10H2
InChIKeyUDFQHPCZZDWAKX-UHFFFAOYSA-N
XLogP2.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-N-{[(2R)-oxolan-2-yl]methyl}cyclohexan-1-amine
CID 40515069
1-Cyclohexyl-N-((tetrahydrofuran-2-yl)methyl)methanamine
CID 3144577
N-(oxolan-2-ylmethyl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 81931195
1-(4,4-difluorocyclohexyl)-N-(oxolan-2-ylmethyl)methanamine
CID 81931213
2,2,2-trifluoro-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)ethanamine
CID 102896747
2,2-difluoro-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)ethanamine
CID 102897655
4,4,4-trifluoro-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)butan-1-amine
CID 102897658
5,5,5-trifluoro-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)pentan-1-amine
CID 102897660
3,3,3-trifluoro-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-1-amine
CID 113750424
[(1-Fluorocyclohexyl)methyl][(oxolan-2-yl)methyl]amine
CID 126847929
[(1-Fluorocyclopentyl)methyl][(oxolan-2-yl)methyl]amine
CID 126847976
(2-Methylpropyl)[(oxolan-2-yl)methyl]amine
CID 14326291

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The IUPAC name of 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine (CID 54856689) is 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The canonical SMILES for 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine is C1CCC(CCNCC2CCCO2)C1.
What is the InChIKey of 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
The InChIKey is UDFQHPCZZDWAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-5-11(4-1)7-8-13-10-12-6-3-9-14-12/h11-13H,1-10H2.
What are the key properties of 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine?
2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine has a molecular weight of 197.32 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(oxolan-2-ylmethyl)ethanamine is sourced from PubChem (CID 54856689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).