[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone

C19H22O3 — CID 71003053

IUPAC[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone
SMILESCOCCc1cc(C)cc(C(=O)c2ccc(OC)c(C)c2)c1
InChIInChI=1S/C19H22O3/c1-13-9-15(7-8-21-3)12-17(10-13)19(20)16-5-6-18(22-4)14(2)11-16/h5-6,9-12H,7-8H2,1-4H3
InChIKeyAEQRXEQNHFNKCR-UHFFFAOYSA-N
MW298.38 g/mol
LogP3.73
Rot. Bonds6

About [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone

[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone (PubChem CID 71003053) has the molecular formula C19H22O3 and a molecular weight of 298.38 g/mol. Its IUPAC name is [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone.

Molecular Properties

Compound Name[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone
PubChem CID71003053
Molecular FormulaC19H22O3
Molecular Weight298.38 g/mol
Exact Mass298.16
IUPAC Name[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone
SMILESCOCCc1cc(C)cc(C(=O)c2ccc(OC)c(C)c2)c1
InChIInChI=1S/C19H22O3/c1-13-9-15(7-8-21-3)12-17(10-13)19(20)16-5-6-18(22-4)14(2)11-16/h5-6,9-12H,7-8H2,1-4H3
InChIKeyAEQRXEQNHFNKCR-UHFFFAOYSA-N
XLogP3.73
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-hydroxyphenyl)-(4-methoxy-3-methylphenyl)methanone
CID 70142361
(4-fluoro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methanone
CID 81283370
(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone
CID 162090190
(4-methoxy-3-methylphenyl)-(4-methylsulfanylphenyl)methanone
CID 79214841
(3,4-dimethoxyphenyl)-(3-fluoro-5-methylphenyl)methanone
CID 79020421
(5-bromothiophen-3-yl)-(4-methoxy-3-methylphenyl)methanone
CID 107959962
(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanone
CID 115787635
(4-methoxy-3-methylphenyl)-thiophen-3-ylmethanone
CID 43463880
(3-bromo-5-chlorophenyl)-(4-methoxy-3-methylphenyl)methanone
CID 107949805
4-methoxy-N-(1-methoxypropan-2-yl)-3-methylbenzamide
CID 18892567
(3-bromo-4-methoxyphenyl)-(3-bromo-5-methylphenyl)methanone
CID 104850964
2-bromo-1-(4-methoxy-3-methylphenyl)ethanone
CID 13440066

Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone?
The IUPAC name of [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone (CID 71003053) is [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone.
What is the SMILES notation for [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone?
The canonical SMILES for [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone is COCCc1cc(C)cc(C(=O)c2ccc(OC)c(C)c2)c1.
What is the InChIKey of [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone?
The InChIKey is AEQRXEQNHFNKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O3/c1-13-9-15(7-8-21-3)12-17(10-13)19(20)16-5-6-18(22-4)14(2)11-16/h5-6,9-12H,7-8H2,1-4H3.
What are the key properties of [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone?
[3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone has a molecular weight of 298.38 g/mol, XLogP of 3.73, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyethyl)-5-methylphenyl]-(4-methoxy-3-methylphenyl)methanone is sourced from PubChem (CID 71003053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).