(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone

C15H13ClO3 — CID 623894

IUPAC(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
SMILESCOc1ccc(OC)c(C(=O)c2ccccc2Cl)c1
InChIInChI=1S/C15H13ClO3/c1-18-10-7-8-14(19-2)12(9-10)15(17)11-5-3-4-6-13(11)16/h3-9H,1-2H3
InChIKeyBUQCLGHMLAJMBX-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.59
Rot. Bonds4

About (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone

(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone (PubChem CID 623894) has the molecular formula C15H13ClO3 and a molecular weight of 276.72 g/mol. Its IUPAC name is (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
PubChem CID623894
Molecular FormulaC15H13ClO3
Molecular Weight276.72 g/mol
Exact Mass276.06
IUPAC Name(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
SMILESCOc1ccc(OC)c(C(=O)c2ccccc2Cl)c1
InChIInChI=1S/C15H13ClO3/c1-18-10-7-8-14(19-2)12(9-10)15(17)11-5-3-4-6-13(11)16/h3-9H,1-2H3
InChIKeyBUQCLGHMLAJMBX-UHFFFAOYSA-N
XLogP3.59
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-2-fluorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 64714149
(2,5-dimethoxyphenyl)-(2-iodophenyl)methanone
CID 15888023
(5-bromo-2-methoxyphenyl)-(2-chlorophenyl)methanone
CID 43339911
[2-(2,5-dimethoxyphenyl)-2-oxoethyl] 2-chlorobenzoate
CID 2096696
(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone
CID 146006285
(2-chlorophenyl)-[5-methoxy-2-(methylamino)phenyl]methanone
CID 134907446
(2-amino-4-methoxyphenyl)-(2-chlorophenyl)methanone
CID 116602267
(2,3-dimethoxyphenyl)-(2,5-dimethoxyphenyl)methanone
CID 69347574
(2-bromo-5-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 105079993
(2-chlorophenyl)-(6-methoxynaphthalen-2-yl)methanone
CID 63491320
(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
CID 86028415
(2-bromophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561746

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone?
The IUPAC name of (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone (CID 623894) is (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone is COc1ccc(OC)c(C(=O)c2ccccc2Cl)c1.
What is the InChIKey of (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone?
The InChIKey is BUQCLGHMLAJMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO3/c1-18-10-7-8-14(19-2)12(9-10)15(17)11-5-3-4-6-13(11)16/h3-9H,1-2H3.
What are the key properties of (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone?
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone has a molecular weight of 276.72 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone is sourced from PubChem (CID 623894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).