cycloheptyl-(2,5-difluorophenyl)methanol

C14H18F2O — CID 55091243

IUPACcycloheptyl-(2,5-difluorophenyl)methanol
SMILESOC(c1cc(F)ccc1F)C1CCCCCC1
InChIInChI=1S/C14H18F2O/c15-11-7-8-13(16)12(9-11)14(17)10-5-3-1-2-4-6-10/h7-10,14,17H,1-6H2
InChIKeyMBKPIYQJZQBKFQ-UHFFFAOYSA-N
MW240.29 g/mol
LogP3.97
Rot. Bonds2

About cycloheptyl-(2,5-difluorophenyl)methanol

cycloheptyl-(2,5-difluorophenyl)methanol (PubChem CID 55091243) has the molecular formula C14H18F2O and a molecular weight of 240.29 g/mol. Its IUPAC name is cycloheptyl-(2,5-difluorophenyl)methanol.

Molecular Properties

Compound Namecycloheptyl-(2,5-difluorophenyl)methanol
PubChem CID55091243
Molecular FormulaC14H18F2O
Molecular Weight240.29 g/mol
Exact Mass240.13
IUPAC Namecycloheptyl-(2,5-difluorophenyl)methanol
SMILESOC(c1cc(F)ccc1F)C1CCCCCC1
InChIInChI=1S/C14H18F2O/c15-11-7-8-13(16)12(9-11)14(17)10-5-3-1-2-4-6-10/h7-10,14,17H,1-6H2
InChIKeyMBKPIYQJZQBKFQ-UHFFFAOYSA-N
XLogP3.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.29
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cycloheptyl-(2,5-difluorophenyl)methanol 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

(R)-cycloheptyl-(2,5-difluorophenyl)methanol
CID 94502433
(2-bromo-4-fluorophenyl)-cyclohexylmethanol
CID 91636325
2-cyclopentyl-1-(2,5-difluorophenyl)ethanol
CID 61101489
azetidin-3-yl-(2,5-difluorophenyl)methanol
CID 130510268
cyclopentyl-(4-fluoro-2-methylphenyl)methanol
CID 62789449
[cyclooctyl-(2,5-difluorophenyl)methyl]hydrazine
CID 105255093
2-[cyclohexyl(methyl)amino]-1-(2,5-difluorophenyl)ethanol
CID 82217055
(R)-(4-bromo-2-fluorophenyl)-cyclohexylmethanol
CID 97027176
cyclobutyl-(4-fluoro-2-methylphenyl)methanol
CID 64987002
2-cyclopropyl-1-(2,5-difluorophenyl)propan-1-ol
CID 83148576
(R)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184618
(S)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184621

Frequently Asked Questions

What is the IUPAC name of cycloheptyl-(2,5-difluorophenyl)methanol?
The IUPAC name of cycloheptyl-(2,5-difluorophenyl)methanol (CID 55091243) is cycloheptyl-(2,5-difluorophenyl)methanol.
What is the SMILES notation for cycloheptyl-(2,5-difluorophenyl)methanol?
The canonical SMILES for cycloheptyl-(2,5-difluorophenyl)methanol is OC(c1cc(F)ccc1F)C1CCCCCC1.
What is the InChIKey of cycloheptyl-(2,5-difluorophenyl)methanol?
The InChIKey is MBKPIYQJZQBKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2O/c15-11-7-8-13(16)12(9-11)14(17)10-5-3-1-2-4-6-10/h7-10,14,17H,1-6H2.
What are the key properties of cycloheptyl-(2,5-difluorophenyl)methanol?
cycloheptyl-(2,5-difluorophenyl)methanol has a molecular weight of 240.29 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl-(2,5-difluorophenyl)methanol is sourced from PubChem (CID 55091243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).