(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone

C15H14O2 — CID 19026877

IUPAC(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone
SMILESCc1cc(C(=O)c2ccccc2)c(C)cc1O
InChIInChI=1S/C15H14O2/c1-10-9-14(16)11(2)8-13(10)15(17)12-6-4-3-5-7-12/h3-9,16H,1-2H3
InChIKeyMDWWYJXDIMXLHU-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.24
Rot. Bonds2

About (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone

(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone (PubChem CID 19026877) has the molecular formula C15H14O2 and a molecular weight of 226.27 g/mol. Its IUPAC name is (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone.

Molecular Properties

Compound Name(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone
PubChem CID19026877
Molecular FormulaC15H14O2
Molecular Weight226.27 g/mol
Exact Mass226.10
IUPAC Name(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone
SMILESCc1cc(C(=O)c2ccccc2)c(C)cc1O
InChIInChI=1S/C15H14O2/c1-10-9-14(16)11(2)8-13(10)15(17)12-6-4-3-5-7-12/h3-9,16H,1-2H3
InChIKeyMDWWYJXDIMXLHU-UHFFFAOYSA-N
XLogP3.24
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-ethoxy-2,5-dimethylphenyl)-phenylmethanone
CID 82628812
(2-hydroxy-5-methoxy-4-methylphenyl)-phenylmethanone;methane
CID 175255493
(2-hydroxy-4-methyl-5-phenyldiazenylphenyl)-phenylmethanone
CID 3578467
(5-benzoyl-2,6-dimethyl-3-pyridinyl)-phenylmethanone
CID 827958
4-benzoyl-6-(4-methylbenzoyl)benzene-1,3-dicarboxylic acid
CID 23586588
2-benzoyl-5-(4-methylbenzoyl)terephthalic acid
CID 23586512
[2-(4-hydroxy-3-methylphenoxy)phenyl]-phenylmethanone
CID 67943677
(2-amino-3,5-dimethylphenyl)-phenylmethanone
CID 70126178
(2,5-dimethyl-4-pyridinyl)-phenylmethanone
CID 12954070
ethane;phenyl-(2,4,6-trimethylphenyl)methanone
CID 90795600
(5-ethyl-2-hydroxyphenyl)-phenylmethanone
CID 13149653
[3-(2,5-dimethylbenzoyl)phenyl]-phenylmethanone
CID 90191697

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone?
The IUPAC name of (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone (CID 19026877) is (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone.
What is the SMILES notation for (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone?
The canonical SMILES for (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone is Cc1cc(C(=O)c2ccccc2)c(C)cc1O.
What is the InChIKey of (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone?
The InChIKey is MDWWYJXDIMXLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-10-9-14(16)11(2)8-13(10)15(17)12-6-4-3-5-7-12/h3-9,16H,1-2H3.
What are the key properties of (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone?
(4-hydroxy-2,5-dimethylphenyl)-phenylmethanone has a molecular weight of 226.27 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-2,5-dimethylphenyl)-phenylmethanone is sourced from PubChem (CID 19026877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).