(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol

C17H17FO3 — CID 115838349

IUPAC(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(OC3CC3)cc2)ccc1F
InChIInChI=1S/C17H17FO3/c1-20-16-10-12(4-9-15(16)18)17(19)11-2-5-13(6-3-11)21-14-7-8-14/h2-6,9-10,14,17,19H,7-8H2,1H3
InChIKeyVRTCVHBZGMIDDM-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.46
Rot. Bonds5

About (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol

(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol (PubChem CID 115838349) has the molecular formula C17H17FO3 and a molecular weight of 288.32 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
PubChem CID115838349
Molecular FormulaC17H17FO3
Molecular Weight288.32 g/mol
Exact Mass288.12
IUPAC Name(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(OC3CC3)cc2)ccc1F
InChIInChI=1S/C17H17FO3/c1-20-16-10-12(4-9-15(16)18)17(19)11-2-5-13(6-3-11)21-14-7-8-14/h2-6,9-10,14,17,19H,7-8H2,1H3
InChIKeyVRTCVHBZGMIDDM-UHFFFAOYSA-N
XLogP3.46
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)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

(4-cyclopropyloxyphenyl)-(3,4-difluorophenyl)methanol
CID 114518537
(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanamine
CID 105051381
(4-fluoro-3-methoxyphenyl)-(4-methoxyphenyl)methanol
CID 81285020
(4-cyclopropyloxyphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 114518560
(3-chloro-4-fluorophenyl)-(4-cyclopropyloxyphenyl)methanol
CID 114518680
(4-cyclobutylphenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 115836236
(3-bromo-4-fluorophenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284804
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353
(4-cyclopropyloxyphenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 115838370
(4-cyclopropyloxyphenyl)-(2-methoxy-4-methylphenyl)methanol
CID 106791062
(3,4-dichlorophenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284055
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol?
The IUPAC name of (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol (CID 115838349) is (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol?
The canonical SMILES for (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol is COc1cc(C(O)c2ccc(OC3CC3)cc2)ccc1F.
What is the InChIKey of (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol?
The InChIKey is VRTCVHBZGMIDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO3/c1-20-16-10-12(4-9-15(16)18)17(19)11-2-5-13(6-3-11)21-14-7-8-14/h2-6,9-10,14,17,19H,7-8H2,1H3.
What are the key properties of (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol?
(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol has a molecular weight of 288.32 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol is sourced from PubChem (CID 115838349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).