2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol

C14H25NO — CID 114339276

IUPAC2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESCC(C)=CCN1CCCC1C1CCCC1O
InChIInChI=1S/C14H25NO/c1-11(2)8-10-15-9-4-6-13(15)12-5-3-7-14(12)16/h8,12-14,16H,3-7,9-10H2,1-2H3
InChIKeyFKOQRTFLCRMZGX-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.58
Rot. Bonds3

About 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol

2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol (PubChem CID 114339276) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
PubChem CID114339276
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESCC(C)=CCN1CCCC1C1CCCC1O
InChIInChI=1S/C14H25NO/c1-11(2)8-10-15-9-4-6-13(15)12-5-3-7-14(12)16/h8,12-14,16H,3-7,9-10H2,1-2H3
InChIKeyFKOQRTFLCRMZGX-UHFFFAOYSA-N
XLogP2.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.58
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

2-[1-(3-Chloro-2-methylprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 106440951
2-(1-Hept-6-enylpyrrolidin-2-yl)cyclopentan-1-ol
CID 107011017
2-(1-Pentan-2-ylpyrrolidin-2-yl)cyclopentan-1-ol
CID 107890499
2-(1-Hexylpyrrolidin-2-yl)cyclopentan-1-ol
CID 113569243
2-[1-(4-Methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 113569280
2-[1-(2-Methylidenebutyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 113569290
2-(1-Cyclohex-2-en-1-ylpyrrolidin-2-yl)cyclopentan-1-ol
CID 113609126
2-[1-(2-Methylpropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339020
2-(1-Butan-2-ylpyrrolidin-2-yl)cyclopentan-1-ol
CID 114339021
2-[1-(3-Methylbutyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339022
2-[1-(2-Methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339035
2-(1-Butylpyrrolidin-2-yl)cyclopentan-1-ol
CID 114339069

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol (CID 114339276) is 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol is CC(C)=CCN1CCCC1C1CCCC1O.
What is the InChIKey of 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The InChIKey is FKOQRTFLCRMZGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-11(2)8-10-15-9-4-6-13(15)12-5-3-7-14(12)16/h8,12-14,16H,3-7,9-10H2,1-2H3.
What are the key properties of 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol has a molecular weight of 223.36 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-methylbut-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 114339276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).