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

C19H17ClO — CID 105076762

IUPAC1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
SMILESOC(Cc1cccc(Cl)c1)Cc1ccc2ccccc2c1
InChIInChI=1S/C19H17ClO/c20-18-7-3-4-14(11-18)12-19(21)13-15-8-9-16-5-1-2-6-17(16)10-15/h1-11,19,21H,12-13H2
InChIKeyHOMMZMIHNUHQAE-UHFFFAOYSA-N
MW296.80 g/mol
LogP4.64
Rot. Bonds4

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

1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol (PubChem CID 105076762) has the molecular formula C19H17ClO and a molecular weight of 296.80 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
PubChem CID105076762
Molecular FormulaC19H17ClO
Molecular Weight296.80 g/mol
Exact Mass296.10
IUPAC Name1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
SMILESOC(Cc1cccc(Cl)c1)Cc1ccc2ccccc2c1
InChIInChI=1S/C19H17ClO/c20-18-7-3-4-14(11-18)12-19(21)13-15-8-9-16-5-1-2-6-17(16)10-15/h1-11,19,21H,12-13H2
InChIKeyHOMMZMIHNUHQAE-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

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Related Compounds

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1-(3-chlorophenyl)-4-phenoxybutan-2-ol
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1-methoxy-3-naphthalen-2-ylpropan-2-ol
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1-(3-chlorophenyl)-4,4-dimethylpentan-2-ol
CID 63016982
1-(3-chlorophenyl)-2-naphthalen-2-ylethanone
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2-(3-chlorophenyl)-1-(2-methylnaphthalen-1-yl)ethanol
CID 81430142
2-(3-chlorophenyl)-N-methyl-1-naphthalen-2-ylethanamine
CID 63412161
1-anthracen-2-ylbutan-2-ol
CID 141488114
1-(3-chlorophenyl)-4-methylpent-4-en-2-ol
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1-(3-bromo-2,6-difluorophenyl)-3-(3-chlorophenyl)propan-2-ol
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(1S)-2-naphthalen-2-yl-1-phenylethanol
CID 101378142

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol?
The IUPAC name of 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol (CID 105076762) is 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol.
What is the SMILES notation for 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol?
The canonical SMILES for 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol is OC(Cc1cccc(Cl)c1)Cc1ccc2ccccc2c1.
What is the InChIKey of 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol?
The InChIKey is HOMMZMIHNUHQAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClO/c20-18-7-3-4-14(11-18)12-19(21)13-15-8-9-16-5-1-2-6-17(16)10-15/h1-11,19,21H,12-13H2.
What are the key properties of 1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol?
1-(3-chlorophenyl)-3-naphthalen-2-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-2-ylpropan-2-ol is sourced from PubChem (CID 105076762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).