2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

C20H21N3O4 — CID 17396421

IUPAC2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCOc1ccccc1Oc1ccc(NC(C)C(=O)Nc2cc(C)on2)cc1
InChIInChI=1S/C20H21N3O4/c1-13-12-19(23-27-13)22-20(24)14(2)21-15-8-10-16(11-9-15)26-18-7-5-4-6-17(18)25-3/h4-12,14,21H,1-3H3,(H,22,23,24)
InChIKeyZOMORJMAIITTQH-UHFFFAOYSA-N
MW367.41 g/mol
LogP4.22
Rot. Bonds7

About 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide (PubChem CID 17396421) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide.

Molecular Properties

Compound Name2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
PubChem CID17396421
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC Name2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCOc1ccccc1Oc1ccc(NC(C)C(=O)Nc2cc(C)on2)cc1
InChIInChI=1S/C20H21N3O4/c1-13-12-19(23-27-13)22-20(24)14(2)21-15-8-10-16(11-9-15)26-18-7-5-4-6-17(18)25-3/h4-12,14,21H,1-3H3,(H,22,23,24)
InChIKeyZOMORJMAIITTQH-UHFFFAOYSA-N
XLogP4.22
TPSA85.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 41016115
(2S)-2-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 40939515
(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40792652
2-[4-(2-methoxyphenoxy)anilino]-N-(3-nitrophenyl)propanamide
CID 134032594
2-[4-(2-methoxyphenoxy)anilino]-N-pentylpropanamide
CID 134039373
(2S)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 112507075
2-(4-methoxyanilino)-N-(2-methoxyphenyl)propanamide
CID 17397275
(2R)-2-[4-methoxy-3-(4-methoxyphenoxy)anilino]-N-(3-methoxyphenyl)propanamide
CID 30296852
(2R)-N-(2-methoxy-5-methylphenyl)-2-(4-phenoxyanilino)propanamide
CID 40799840
(2S)-N-(2-methoxy-5-methylphenyl)-2-(4-phenoxyanilino)propanamide
CID 40799845
2-(2-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 17499493
(2R)-2-(3-iodo-4-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 25350917

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The IUPAC name of 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide (CID 17396421) is 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide.
What is the SMILES notation for 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The canonical SMILES for 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide is COc1ccccc1Oc1ccc(NC(C)C(=O)Nc2cc(C)on2)cc1.
What is the InChIKey of 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The InChIKey is ZOMORJMAIITTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c1-13-12-19(23-27-13)22-20(24)14(2)21-15-8-10-16(11-9-15)26-18-7-5-4-6-17(18)25-3/h4-12,14,21H,1-3H3,(H,22,23,24).
What are the key properties of 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide has a molecular weight of 367.41 g/mol, XLogP of 4.22, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide is sourced from PubChem (CID 17396421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).