2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol

C18H26FNO — CID 114347509

IUPAC2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
SMILESCc1cc(F)ccc1CC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C18H26FNO/c1-14-12-16(19)7-6-15(14)13-17(21)18(8-2-3-9-18)20-10-4-5-11-20/h6-7,12,17,21H,2-5,8-11,13H2,1H3
InChIKeyQBVGVKLNOKIEDT-UHFFFAOYSA-N
MW291.41 g/mol
LogP3.45
Rot. Bonds4

About 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol

2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol (PubChem CID 114347509) has the molecular formula C18H26FNO and a molecular weight of 291.41 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
PubChem CID114347509
Molecular FormulaC18H26FNO
Molecular Weight291.41 g/mol
Exact Mass291.20
IUPAC Name2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
SMILESCc1cc(F)ccc1CC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C18H26FNO/c1-14-12-16(19)7-6-15(14)13-17(21)18(8-2-3-9-18)20-10-4-5-11-20/h6-7,12,17,21H,2-5,8-11,13H2,1H3
InChIKeyQBVGVKLNOKIEDT-UHFFFAOYSA-N
XLogP3.45
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.41
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,5-dimethylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
CID 79060566
2-(4-chloro-3-fluorophenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
CID 107884295
(2,4-difluorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanol
CID 79057689
1-(4-fluoro-2-methylphenyl)propan-2-ol
CID 91636360
2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanol
CID 105377576
(4-fluoro-3-methylphenyl)-(1-piperidin-1-ylcyclopentyl)methanol
CID 79057735
1-cyclopentyl-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346848
2-(furan-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
CID 83174790
2-(furan-2-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanol
CID 83174976
1-(1,1-dioxothian-2-yl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 115838262
2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine
CID 114348186
(2,4-difluorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79057699

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol (CID 114347509) is 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol is Cc1cc(F)ccc1CC(O)C1(N2CCCC2)CCCC1.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol?
The InChIKey is QBVGVKLNOKIEDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FNO/c1-14-12-16(19)7-6-15(14)13-17(21)18(8-2-3-9-18)20-10-4-5-11-20/h6-7,12,17,21H,2-5,8-11,13H2,1H3.
What are the key properties of 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol?
2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol has a molecular weight of 291.41 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol is sourced from PubChem (CID 114347509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).