1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol

C19H17ClO — CID 62608540

IUPAC1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol
SMILESOC(Cc1cccc(Cl)c1)Cc1cccc2ccccc12
InChIInChI=1S/C19H17ClO/c20-17-9-3-5-14(11-17)12-18(21)13-16-8-4-7-15-6-1-2-10-19(15)16/h1-11,18,21H,12-13H2
InChIKeyCOBRRZGIBOHUTN-UHFFFAOYSA-N
MW296.80 g/mol
LogP4.64
Rot. Bonds4

About 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol

1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol (PubChem CID 62608540) has the molecular formula C19H17ClO and a molecular weight of 296.80 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol
PubChem CID62608540
Molecular FormulaC19H17ClO
Molecular Weight296.80 g/mol
Exact Mass296.10
IUPAC Name1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol
SMILESOC(Cc1cccc(Cl)c1)Cc1cccc2ccccc12
InChIInChI=1S/C19H17ClO/c20-17-9-3-5-14(11-17)12-18(21)13-16-8-4-7-15-6-1-2-10-19(15)16/h1-11,18,21H,12-13H2
InChIKeyCOBRRZGIBOHUTN-UHFFFAOYSA-N
XLogP4.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-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-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105076762
1-[(3-chlorophenyl)methyl]naphthalene
CID 173131881
2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol
CID 81430142
1-(3-chlorophenyl)-4-(2-methylphenyl)butan-2-ol
CID 63016247
1-chloro-2-naphthalen-1-ylethanol
CID 54087449
1-[1-bromo-2-(3-chlorophenyl)ethyl]naphthalene
CID 63530424
1,1,1-trifluoro-3-naphthalen-1-ylpropan-2-ol
CID 62963158
1-(3-chlorophenyl)-4,4-dimethylpentan-2-ol
CID 63016982
1-(1-benzofuran-7-ylmethylamino)-3-(3-chlorophenyl)propan-2-ol
CID 166372295
1-(3-chlorophenyl)-4-methylpent-4-en-2-ol
CID 79178681
1-naphthalen-1-yl-3-thiophen-2-ylpropan-2-ol
CID 62606396
1-(7-methoxynaphthalen-1-yl)-3-phenylpropan-2-ol
CID 115506158

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol?
The IUPAC name of 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol (CID 62608540) is 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol.
What is the SMILES notation for 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol?
The canonical SMILES for 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol is OC(Cc1cccc(Cl)c1)Cc1cccc2ccccc12.
What is the InChIKey of 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol?
The InChIKey is COBRRZGIBOHUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClO/c20-17-9-3-5-14(11-17)12-18(21)13-16-8-4-7-15-6-1-2-10-19(15)16/h1-11,18,21H,12-13H2.
What are the key properties of 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol?
1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol has a molecular weight of 296.80 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-naphthalen-1-ylpropan-2-ol is sourced from PubChem (CID 62608540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).