(4-benzoylcyclohexyl)-phenylmethanone

C20H20O2 — CID 24722598

IUPAC(4-benzoylcyclohexyl)-phenylmethanone
SMILESO=C(c1ccccc1)C1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C20H20O2/c21-19(15-7-3-1-4-8-15)17-11-13-18(14-12-17)20(22)16-9-5-2-6-10-16/h1-10,17-18H,11-14H2
InChIKeyGTXZAUIOHMLNKP-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.56
Rot. Bonds4

About (4-benzoylcyclohexyl)-phenylmethanone

(4-benzoylcyclohexyl)-phenylmethanone (PubChem CID 24722598) has the molecular formula C20H20O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is (4-benzoylcyclohexyl)-phenylmethanone.

Molecular Properties

Compound Name(4-benzoylcyclohexyl)-phenylmethanone
PubChem CID24722598
Molecular FormulaC20H20O2
Molecular Weight292.38 g/mol
Exact Mass292.15
IUPAC Name(4-benzoylcyclohexyl)-phenylmethanone
SMILESO=C(c1ccccc1)C1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C20H20O2/c21-19(15-7-3-1-4-8-15)17-11-13-18(14-12-17)20(22)16-9-5-2-6-10-16/h1-10,17-18H,11-14H2
InChIKeyGTXZAUIOHMLNKP-UHFFFAOYSA-N
XLogP4.56
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl(phenyl)methanone;molecular hydrogen
CID 143135360
(3-fluorocyclopentyl)-phenylmethanone
CID 118362801
phenyl-(4-piperidin-1-ylcyclohexyl)methanone
CID 25984
[(4Z)-cyclooct-4-en-1-yl]-phenylmethanone
CID 177309073
cyclopentyl-(4-phenylphenyl)methanone
CID 43337740
carbonic acid;cyclopropyl-(4-fluorophenyl)methanone
CID 70591136
4-(4-carboxycyclohexanecarbonyl)benzoic acid
CID 71338600
phenyl-[(3R)-pyrrolidin-3-yl]methanone
CID 86327261
[1-(cyclopropylmethyl)piperidin-4-yl]-phenylmethanone
CID 136515283
[1-(2-aminoethyl)piperidin-4-yl]-phenylmethanone
CID 91529814
cyclopropyl-(4-phenylmethoxyphenyl)methanone
CID 6482534
cyclobutyl(phenyl)methanol;cyclobutyl(phenyl)methanone
CID 165038492

Frequently Asked Questions

What is the IUPAC name of (4-benzoylcyclohexyl)-phenylmethanone?
The IUPAC name of (4-benzoylcyclohexyl)-phenylmethanone (CID 24722598) is (4-benzoylcyclohexyl)-phenylmethanone.
What is the SMILES notation for (4-benzoylcyclohexyl)-phenylmethanone?
The canonical SMILES for (4-benzoylcyclohexyl)-phenylmethanone is O=C(c1ccccc1)C1CCC(C(=O)c2ccccc2)CC1.
What is the InChIKey of (4-benzoylcyclohexyl)-phenylmethanone?
The InChIKey is GTXZAUIOHMLNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20O2/c21-19(15-7-3-1-4-8-15)17-11-13-18(14-12-17)20(22)16-9-5-2-6-10-16/h1-10,17-18H,11-14H2.
What are the key properties of (4-benzoylcyclohexyl)-phenylmethanone?
(4-benzoylcyclohexyl)-phenylmethanone has a molecular weight of 292.38 g/mol, XLogP of 4.56, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzoylcyclohexyl)-phenylmethanone is sourced from PubChem (CID 24722598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).