(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine

C10H17NO — CID 79880012

IUPAC(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine
SMILESNC1CC/C(=C/C2CCCO2)C1
InChIInChI=1S/C10H17NO/c11-9-4-3-8(6-9)7-10-2-1-5-12-10/h7,9-10H,1-6,11H2/b8-7-
InChIKeyHYSFSRPLLCIAKQ-FPLPWBNLSA-N
MW167.25 g/mol
LogP1.60
Rot. Bonds1

About (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine

(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine (PubChem CID 79880012) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine.

Molecular Properties

Compound Name(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine
PubChem CID79880012
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine
SMILESNC1CC/C(=C/C2CCCO2)C1
InChIInChI=1S/C10H17NO/c11-9-4-3-8(6-9)7-10-2-1-5-12-10/h7,9-10H,1-6,11H2/b8-7-
InChIKeyHYSFSRPLLCIAKQ-FPLPWBNLSA-N
XLogP1.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine?
The IUPAC name of (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine (CID 79880012) is (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine.
What is the SMILES notation for (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine?
The canonical SMILES for (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine is NC1CC/C(=C/C2CCCO2)C1.
What is the InChIKey of (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine?
The InChIKey is HYSFSRPLLCIAKQ-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H17NO/c11-9-4-3-8(6-9)7-10-2-1-5-12-10/h7,9-10H,1-6,11H2/b8-7-.
What are the key properties of (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine?
(3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine has a molecular weight of 167.25 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-(oxolan-2-ylmethylidene)cyclopentan-1-amine is sourced from PubChem (CID 79880012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).