1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone

C24H22O — CID 132573010

IUPAC1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone
SMILESO=C(CC1=C(c2ccccc2)CCCC1)c1ccc2ccccc2c1
InChIInChI=1S/C24H22O/c25-24(22-15-14-18-8-4-5-11-20(18)16-22)17-21-12-6-7-13-23(21)19-9-2-1-3-10-19/h1-5,8-11,14-16H,6-7,12-13,17H2
InChIKeyGZJMBGXTKACHOU-UHFFFAOYSA-N
MW326.44 g/mol
LogP6.44
Rot. Bonds4

About 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone

1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone (PubChem CID 132573010) has the molecular formula C24H22O and a molecular weight of 326.44 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone
PubChem CID132573010
Molecular FormulaC24H22O
Molecular Weight326.44 g/mol
Exact Mass326.17
IUPAC Name1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone
SMILESO=C(CC1=C(c2ccccc2)CCCC1)c1ccc2ccccc2c1
InChIInChI=1S/C24H22O/c25-24(22-15-14-18-8-4-5-11-20(18)16-22)17-21-12-6-7-13-23(21)19-9-2-1-3-10-19/h1-5,8-11,14-16H,6-7,12-13,17H2
InChIKeyGZJMBGXTKACHOU-UHFFFAOYSA-N
XLogP6.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.44
LogP ≤ 56.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone
CID 135034335
1,4-dinaphthalen-2-ylbutane-1,4-dione
CID 593323
1-naphthalen-2-yl-2-[4-(trifluoromethyl)phenyl]ethanone
CID 154014777
naphthalene-2-carboxylic acid
CID 175967775
CID 87197273
CID 87197273
1-phenyl-2-[2-(trimethylstannylmethyl)cyclohexen-1-yl]ethanone
CID 135006832
naphthalene-2-carboxylic acid;dihydrochloride
CID 70357946
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145
dinaphthalen-2-ylmethanone
CID 10945915
(2-naphthalen-2-yl-2-oxoethyl) 2-phenylacetate
CID 888123
[2-oxo-2-(4-phenylphenyl)ethyl] naphthalene-2-carboxylate
CID 7698509
1-naphthalen-2-yl-2-(thiepan-1-ium-1-yl)ethanone
CID 142377238

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone?
The IUPAC name of 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone (CID 132573010) is 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone.
What is the SMILES notation for 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone?
The canonical SMILES for 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone is O=C(CC1=C(c2ccccc2)CCCC1)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone?
The InChIKey is GZJMBGXTKACHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O/c25-24(22-15-14-18-8-4-5-11-20(18)16-22)17-21-12-6-7-13-23(21)19-9-2-1-3-10-19/h1-5,8-11,14-16H,6-7,12-13,17H2.
What are the key properties of 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone?
1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone has a molecular weight of 326.44 g/mol, XLogP of 6.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone is sourced from PubChem (CID 132573010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).