2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol

C19H17ClO — CID 81430142

IUPAC2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol
SMILESCc1ccc2ccccc2c1C(O)Cc1cccc(Cl)c1
InChIInChI=1S/C19H17ClO/c1-13-9-10-15-6-2-3-8-17(15)19(13)18(21)12-14-5-4-7-16(20)11-14/h2-11,18,21H,12H2,1H3
InChIKeyDOZAKEGRTSGBNS-UHFFFAOYSA-N
MW296.80 g/mol
LogP5.08
Rot. Bonds3

About 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol

2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol (PubChem CID 81430142) has the molecular formula C19H17ClO and a molecular weight of 296.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol
PubChem CID81430142
Molecular FormulaC19H17ClO
Molecular Weight296.80 g/mol
Exact Mass296.10
IUPAC Name2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol
SMILESCc1ccc2ccccc2c1C(O)Cc1cccc(Cl)c1
InChIInChI=1S/C19H17ClO/c1-13-9-10-15-6-2-3-8-17(15)19(13)18(21)12-14-5-4-7-16(20)11-14/h2-11,18,21H,12H2,1H3
InChIKeyDOZAKEGRTSGBNS-UHFFFAOYSA-N
XLogP5.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.80
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)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

1-[1-chloro-2-(3-chlorophenyl)ethyl]-2-methylnaphthalene
CID 81430010
1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 80502673
2-(3-chlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62387586
1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol
CID 62608540
1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105076762
2-(3-chlorophenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 66271614
2-(3-chlorophenyl)-1-(5-methylfuran-3-yl)ethanol
CID 114822934
1-[bromo-(5-chloro-2-methylphenyl)methyl]-2-methylnaphthalene
CID 82874592
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
1-[1-bromo-2-(3-chlorophenyl)ethyl]naphthalene
CID 63530424
1-[chloro-(2,4-dichlorophenyl)methyl]-2-methylnaphthalene
CID 81430002
1-[chloro-(2,5-dichlorophenyl)methyl]-2-methylnaphthalene
CID 81429992

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol?
The IUPAC name of 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol (CID 81430142) is 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol?
The canonical SMILES for 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol is Cc1ccc2ccccc2c1C(O)Cc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol?
The InChIKey is DOZAKEGRTSGBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClO/c1-13-9-10-15-6-2-3-8-17(15)19(13)18(21)12-14-5-4-7-16(20)11-14/h2-11,18,21H,12H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol?
2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol has a molecular weight of 296.80 g/mol, XLogP of 5.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol is sourced from PubChem (CID 81430142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).