N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide

C18H21N3O3 — CID 51224557

IUPACN-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNc1cccc(C)c1
InChIInChI=1S/C18H21N3O3/c1-12-5-4-6-14(9-12)19-11-18(23)21-16-10-15(20-13(2)22)7-8-17(16)24-3/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyZXGOEJNFRJWPCP-UHFFFAOYSA-N
MW327.38 g/mol
LogP3.01
Rot. Bonds6

About N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide

N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide (PubChem CID 51224557) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide
PubChem CID51224557
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNc1cccc(C)c1
InChIInChI=1S/C18H21N3O3/c1-12-5-4-6-14(9-12)19-11-18(23)21-16-10-15(20-13(2)22)7-8-17(16)24-3/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyZXGOEJNFRJWPCP-UHFFFAOYSA-N
XLogP3.01
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 53.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamido-4-fluoroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 31766831
2-(5-acetamido-2-fluoroanilino)-N-(5-acetamido-2-methoxyphenyl)acetamide
CID 37279177
N-(5-acetamido-2-methoxyphenyl)-2-[4-methyl-3-(trifluoromethyl)anilino]acetamide
CID 24614942
N-(5-acetamido-2-methoxyphenyl)-2-(4-ethylsulfonylanilino)acetamide
CID 16609082
2-(3,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 9098774
4-[[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 24614766
2-(5-acetamido-2-methoxyanilino)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 55437054
N-(5-acetamido-2-methoxyphenyl)-2-(4-methylphenyl)acetamide
CID 17432370
N'-(5-chloro-2-methoxyphenyl)-N-(3-methylphenyl)propanediamide
CID 108953026
N-(3-acetylphenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009580
2-(3-bromoanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9080374
(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide
CID 8873735

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide (CID 51224557) is N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide is COc1ccc(NC(C)=O)cc1NC(=O)CNc1cccc(C)c1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide?
The InChIKey is ZXGOEJNFRJWPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-12-5-4-6-14(9-12)19-11-18(23)21-16-10-15(20-13(2)22)7-8-17(16)24-3/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide has a molecular weight of 327.38 g/mol, XLogP of 3.01, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide is sourced from PubChem (CID 51224557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).