3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol

C15H27NO — CID 79060164

IUPAC3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol
SMILESC=C(CC)CC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C15H27NO/c1-3-13(2)12-14(17)15(8-4-5-9-15)16-10-6-7-11-16/h14,17H,2-12H2,1H3
InChIKeyHVRNCROKCDVILY-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.11
Rot. Bonds5

About 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol

3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol (PubChem CID 79060164) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol.

Molecular Properties

Compound Name3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol
PubChem CID79060164
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol
SMILESC=C(CC)CC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C15H27NO/c1-3-13(2)12-14(17)15(8-4-5-9-15)16-10-6-7-11-16/h14,17H,2-12H2,1H3
InChIKeyHVRNCROKCDVILY-UHFFFAOYSA-N
XLogP3.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.11
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 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol?
The IUPAC name of 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol (CID 79060164) is 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol.
What is the SMILES notation for 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol?
The canonical SMILES for 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol is C=C(CC)CC(O)C1(N2CCCC2)CCCC1.
What is the InChIKey of 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol?
The InChIKey is HVRNCROKCDVILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-3-13(2)12-14(17)15(8-4-5-9-15)16-10-6-7-11-16/h14,17H,2-12H2,1H3.
What are the key properties of 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol?
3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol has a molecular weight of 237.39 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol is sourced from PubChem (CID 79060164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).