1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol

C16H17ClO2 — CID 54919291

IUPAC1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol
SMILESCOc1cccc(C(C)(O)Cc2ccccc2Cl)c1
InChIInChI=1S/C16H17ClO2/c1-16(18,11-12-6-3-4-9-15(12)17)13-7-5-8-14(10-13)19-2/h3-10,18H,11H2,1-2H3
InChIKeyICVVDHCAGMCBSB-UHFFFAOYSA-N
MW276.76 g/mol
LogP3.80
Rot. Bonds4

About 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol

1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol (PubChem CID 54919291) has the molecular formula C16H17ClO2 and a molecular weight of 276.76 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol
PubChem CID54919291
Molecular FormulaC16H17ClO2
Molecular Weight276.76 g/mol
Exact Mass276.09
IUPAC Name1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol
SMILESCOc1cccc(C(C)(O)Cc2ccccc2Cl)c1
InChIInChI=1S/C16H17ClO2/c1-16(18,11-12-6-3-4-9-15(12)17)13-7-5-8-14(10-13)19-2/h3-10,18H,11H2,1-2H3
InChIKeyICVVDHCAGMCBSB-UHFFFAOYSA-N
XLogP3.80
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.76
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol 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

1-(4-chloro-2-fluorophenyl)-2-(3-methoxyphenyl)propan-2-ol
CID 114851769
2-(3-methoxyphenyl)-1-phenylpropan-2-ol
CID 43810200
1-(4-bromo-2-fluorophenyl)-2-(3-methoxyphenyl)propan-2-ol
CID 65144721
2-(3-chlorophenyl)-1-(2,3-dichlorophenyl)propan-2-ol
CID 107307348
(2S,3S)-2,3-bis(3-methoxyphenyl)butane-2,3-diol
CID 101270093
1-(3-methoxyphenyl)-1-phenylethanol
CID 15680503
(1S)-1-(3-methoxyphenyl)-1-phenylethanol
CID 29415940
1-(2-bromo-5-methoxyphenyl)-2-(3-bromophenyl)propan-2-ol
CID 65327501
N-[(2-chlorophenyl)methyl]-3-methoxyaniline
CID 23795463
1-(1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)propan-2-ol
CID 79825717
1-fluoro-1-(3-methoxyphenyl)ethanol
CID 174577353
1-(2-bromophenyl)-2-(3-chlorophenyl)propan-2-ol
CID 60797682

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol (CID 54919291) is 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol is COc1cccc(C(C)(O)Cc2ccccc2Cl)c1.
What is the InChIKey of 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol?
The InChIKey is ICVVDHCAGMCBSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO2/c1-16(18,11-12-6-3-4-9-15(12)17)13-7-5-8-14(10-13)19-2/h3-10,18H,11H2,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol?
1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol has a molecular weight of 276.76 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-(3-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 54919291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).