methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate

C19H21NO5 — CID 4231793

IUPACmethyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate
SMILESCOC(=O)C(C)Oc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H21NO5/c1-12-5-10-17(23-3)16(11-12)20-18(21)14-6-8-15(9-7-14)25-13(2)19(22)24-4/h5-11,13H,1-4H3,(H,20,21)
InChIKeyYAERQQAZTSFFNL-UHFFFAOYSA-N
MW343.38 g/mol
LogP3.20
Rot. Bonds6

About methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate

methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate (PubChem CID 4231793) has the molecular formula C19H21NO5 and a molecular weight of 343.38 g/mol. Its IUPAC name is methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate.

Molecular Properties

Compound Namemethyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate
PubChem CID4231793
Molecular FormulaC19H21NO5
Molecular Weight343.38 g/mol
Exact Mass343.14
IUPAC Namemethyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate
SMILESCOC(=O)C(C)Oc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H21NO5/c1-12-5-10-17(23-3)16(11-12)20-18(21)14-6-8-15(9-7-14)25-13(2)19(22)24-4/h5-11,13H,1-4H3,(H,20,21)
InChIKeyYAERQQAZTSFFNL-UHFFFAOYSA-N
XLogP3.20
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxy-N-(2-methoxy-5-methylphenyl)benzamide
CID 2302629
N-(2-methoxy-5-methylphenyl)-4-(2-methylpropanoylamino)benzamide
CID 46547571
ethyl (2R)-2-[4-[(2-methoxyphenyl)carbamoyl]phenoxy]propanoate
CID 731943
N-(5-amino-2-methoxyphenyl)-4-butan-2-yloxybenzamide
CID 46735867
(2R)-2-(3,4-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)propanamide
CID 26539879
2-(3,4-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)propanamide
CID 24511206
propan-2-yl 2-[4-[(2,4-dimethylphenyl)carbamoyl]phenoxy]propanoate
CID 3712073
methyl 2-[4-[(4-chloro-2-methylphenyl)carbamoyl]phenoxy]propanoate
CID 3428091
4-formyl-N-(2-methoxy-5-methylphenyl)benzamide
CID 134025426
[4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 2-(2,5-dimethylphenoxy)propanoate
CID 53266948
[2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] 2-(4-methoxyphenoxy)propanoate
CID 46603193
[4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 2-(3-methylphenoxy)propanoate
CID 53265910

Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate?
The IUPAC name of methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate (CID 4231793) is methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate.
What is the SMILES notation for methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate?
The canonical SMILES for methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate is COC(=O)C(C)Oc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1.
What is the InChIKey of methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate?
The InChIKey is YAERQQAZTSFFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO5/c1-12-5-10-17(23-3)16(11-12)20-18(21)14-6-8-15(9-7-14)25-13(2)19(22)24-4/h5-11,13H,1-4H3,(H,20,21).
What are the key properties of methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate?
methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate has a molecular weight of 343.38 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[4-[(2-methoxy-5-methylphenyl)carbamoyl]phenoxy]propanoate is sourced from PubChem (CID 4231793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).