(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone

C16H15ClO3 — CID 79020316

IUPAC(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)c1cc(Cl)ccc1OC
InChIInChI=1S/C16H15ClO3/c1-3-20-15-7-5-4-6-12(15)16(18)13-10-11(17)8-9-14(13)19-2/h4-10H,3H2,1-2H3
InChIKeyRXEUXGGBUMJUFK-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.98
Rot. Bonds5

About (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone

(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone (PubChem CID 79020316) has the molecular formula C16H15ClO3 and a molecular weight of 290.75 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone
PubChem CID79020316
Molecular FormulaC16H15ClO3
Molecular Weight290.75 g/mol
Exact Mass290.07
IUPAC Name(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)c1cc(Cl)ccc1OC
InChIInChI=1S/C16H15ClO3/c1-3-20-15-7-5-4-6-12(15)16(18)13-10-11(17)8-9-14(13)19-2/h4-10H,3H2,1-2H3
InChIKeyRXEUXGGBUMJUFK-UHFFFAOYSA-N
XLogP3.98
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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(2-tert-butylphenyl)-(5-chloro-2-methoxyphenyl)methanone
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(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
CID 86028415
5-chloro-N-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]ethyl]-2-methoxybenzamide
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(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 112694005
(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methanone
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(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
CID 113425387
1-(2,5-dichlorophenyl)-4-(2-methoxyphenyl)butane-1,4-dione
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(5-chloro-2-methoxyphenyl)-(2-iodo-3-methylphenyl)methanone
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Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone (CID 79020316) is (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone is CCOc1ccccc1C(=O)c1cc(Cl)ccc1OC.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone?
The InChIKey is RXEUXGGBUMJUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClO3/c1-3-20-15-7-5-4-6-12(15)16(18)13-10-11(17)8-9-14(13)19-2/h4-10H,3H2,1-2H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone?
(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone has a molecular weight of 290.75 g/mol, XLogP of 3.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone is sourced from PubChem (CID 79020316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).