3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine

C15H25NO — CID 102902823

IUPAC3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine
SMILESNC1CCC(=CC2CCC3(CCCCC3)O2)C1
InChIInChI=1S/C15H25NO/c16-13-5-4-12(10-13)11-14-6-9-15(17-14)7-2-1-3-8-15/h11,13-14H,1-10,16H2
InChIKeyWSXDVYFWXLVDKY-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.31
Rot. Bonds1

About 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine

3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine (PubChem CID 102902823) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine
PubChem CID102902823
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine
SMILESNC1CCC(=CC2CCC3(CCCCC3)O2)C1
InChIInChI=1S/C15H25NO/c16-13-5-4-12(10-13)11-14-6-9-15(17-14)7-2-1-3-8-15/h11,13-14H,1-10,16H2
InChIKeyWSXDVYFWXLVDKY-UHFFFAOYSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.31
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

6-Methyl-4-(2-methyloxolan-2-yl)cyclohex-3-en-1-amine
CID 89074181
(1S,5R,6R)-6-methyl-5-pentan-3-yloxy-3-propan-2-ylcyclohex-3-en-1-amine
CID 89804945
4-(Oxolan-2-ylmethylidene)cyclohexan-1-amine
CID 79879471
(3Z)-3-(oxolan-2-ylmethylidene)cyclohexan-1-amine
CID 79880456
(E)-2-cyclohexyl-3-(oxolan-2-yl)prop-2-en-1-amine
CID 82838397
3-(1-Oxaspiro[4.4]nonan-2-ylmethyl)cyclohex-2-en-1-amine
CID 102901377
3-(1-Oxaspiro[4.5]decan-2-ylmethyl)cyclopent-2-en-1-amine
CID 102901380
3-(1-Oxaspiro[4.4]nonan-2-ylmethyl)cyclopent-2-en-1-amine
CID 102901381
4-(1-Oxaspiro[4.4]nonan-2-ylmethylidene)piperidine
CID 102902806
(3Z)-3-(1-oxaspiro[4.4]nonan-2-ylmethylidene)piperidine
CID 102902809
4-(1-Oxaspiro[4.5]decan-2-ylmethylidene)cyclohexan-1-amine
CID 102902812
4-(1-Oxaspiro[4.4]nonan-2-ylmethylidene)cyclohexan-1-amine
CID 102902814

Frequently Asked Questions

What is the IUPAC name of 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine?
The IUPAC name of 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine (CID 102902823) is 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine.
What is the SMILES notation for 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine?
The canonical SMILES for 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine is NC1CCC(=CC2CCC3(CCCCC3)O2)C1.
What is the InChIKey of 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine?
The InChIKey is WSXDVYFWXLVDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c16-13-5-4-12(10-13)11-14-6-9-15(17-14)7-2-1-3-8-15/h11,13-14H,1-10,16H2.
What are the key properties of 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine?
3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-oxaspiro[4.5]decan-2-ylmethylidene)cyclopentan-1-amine is sourced from PubChem (CID 102902823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).