3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine

C11H19NO — CID 79879280

IUPAC3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine
SMILESNC1CCC(=CCC2CCCO2)C1
InChIInChI=1S/C11H19NO/c12-10-5-3-9(8-10)4-6-11-2-1-7-13-11/h4,10-11H,1-3,5-8,12H2
InChIKeyINQFSLFTINMGDM-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.99
Rot. Bonds2

About 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine

3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine (PubChem CID 79879280) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine
PubChem CID79879280
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine
SMILESNC1CCC(=CCC2CCCO2)C1
InChIInChI=1S/C11H19NO/c12-10-5-3-9(8-10)4-6-11-2-1-7-13-11/h4,10-11H,1-3,5-8,12H2
InChIKeyINQFSLFTINMGDM-UHFFFAOYSA-N
XLogP1.99
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Cyclopenten-1-yl(oxolan-2-yl)methanamine
CID 62079404
1-(Cyclopenten-1-yl)-2-(oxolan-2-yl)ethanamine
CID 65156098
1-(Cyclopenten-1-yl)-3-(oxolan-2-yl)propan-1-amine
CID 65156146
1-(Cyclohexen-1-yl)-2-(oxolan-2-yl)ethanamine
CID 65156745
1-(Cyclohexen-1-yl)-3-(oxolan-2-yl)propan-1-amine
CID 65156794
3-[2-(Oxolan-2-yl)ethyl]cyclohex-2-en-1-amine
CID 65171598
3-[3-(Oxolan-2-yl)propyl]cyclohex-2-en-1-amine
CID 65171754
3-(Oxolan-2-ylmethyl)cyclohex-2-en-1-amine
CID 65172053
3-[3-(Oxolan-2-yl)propyl]cyclopent-2-en-1-amine
CID 65174055
3-(Oxolan-2-ylmethyl)cyclopent-2-en-1-amine
CID 65174346
3-[2-(Oxolan-2-yl)ethyl]cyclopent-2-en-1-amine
CID 65174471
3-Methyl-1-(oxolan-2-yl)but-2-en-1-amine
CID 79180101

Frequently Asked Questions

What is the IUPAC name of 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine?
The IUPAC name of 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine (CID 79879280) is 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine.
What is the SMILES notation for 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine?
The canonical SMILES for 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine is NC1CCC(=CCC2CCCO2)C1.
What is the InChIKey of 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine?
The InChIKey is INQFSLFTINMGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c12-10-5-3-9(8-10)4-6-11-2-1-7-13-11/h4,10-11H,1-3,5-8,12H2.
What are the key properties of 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine?
3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(oxolan-2-yl)ethylidene]cyclopentan-1-amine is sourced from PubChem (CID 79879280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).