(2-fluorophenyl)-(4-propylphenyl)methanol

C16H17FO — CID 61087386

IUPAC(2-fluorophenyl)-(4-propylphenyl)methanol
SMILESCCCc1ccc(C(O)c2ccccc2F)cc1
InChIInChI=1S/C16H17FO/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-11,16,18H,2,5H2,1H3
InChIKeyQDUOJWTVQHTKOE-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.86
Rot. Bonds4

About (2-fluorophenyl)-(4-propylphenyl)methanol

(2-fluorophenyl)-(4-propylphenyl)methanol (PubChem CID 61087386) has the molecular formula C16H17FO and a molecular weight of 244.31 g/mol. Its IUPAC name is (2-fluorophenyl)-(4-propylphenyl)methanol.

Molecular Properties

Compound Name(2-fluorophenyl)-(4-propylphenyl)methanol
PubChem CID61087386
Molecular FormulaC16H17FO
Molecular Weight244.31 g/mol
Exact Mass244.13
IUPAC Name(2-fluorophenyl)-(4-propylphenyl)methanol
SMILESCCCc1ccc(C(O)c2ccccc2F)cc1
InChIInChI=1S/C16H17FO/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-11,16,18H,2,5H2,1H3
InChIKeyQDUOJWTVQHTKOE-UHFFFAOYSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2-fluorophenyl)-(4-propylphenyl)methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(4-propylphenyl)methanol?
The IUPAC name of (2-fluorophenyl)-(4-propylphenyl)methanol (CID 61087386) is (2-fluorophenyl)-(4-propylphenyl)methanol.
What is the SMILES notation for (2-fluorophenyl)-(4-propylphenyl)methanol?
The canonical SMILES for (2-fluorophenyl)-(4-propylphenyl)methanol is CCCc1ccc(C(O)c2ccccc2F)cc1.
What is the InChIKey of (2-fluorophenyl)-(4-propylphenyl)methanol?
The InChIKey is QDUOJWTVQHTKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-11,16,18H,2,5H2,1H3.
What are the key properties of (2-fluorophenyl)-(4-propylphenyl)methanol?
(2-fluorophenyl)-(4-propylphenyl)methanol has a molecular weight of 244.31 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(4-propylphenyl)methanol is sourced from PubChem (CID 61087386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).