[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate

C19H21NO5 — CID 7833581

IUPAC[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
SMILESCOc1ccccc1NC(=O)[C@@H](C)OC(=O)[C@H](C)Oc1ccccc1
InChIInChI=1S/C19H21NO5/c1-13(18(21)20-16-11-7-8-12-17(16)23-3)25-19(22)14(2)24-15-9-5-4-6-10-15/h4-14H,1-3H3,(H,20,21)/t13-,14+/m1/s1
InChIKeyGCPVWGYSJUDKCH-KGLIPLIRSA-N
MW343.38 g/mol
LogP3.03
Rot. Bonds7

About [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate

[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate (PubChem CID 7833581) has the molecular formula C19H21NO5 and a molecular weight of 343.38 g/mol. Its IUPAC name is [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate.

Molecular Properties

Compound Name[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
PubChem CID7833581
Molecular FormulaC19H21NO5
Molecular Weight343.38 g/mol
Exact Mass343.14
IUPAC Name[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
SMILESCOc1ccccc1NC(=O)[C@@H](C)OC(=O)[C@H](C)Oc1ccccc1
InChIInChI=1S/C19H21NO5/c1-13(18(21)20-16-11-7-8-12-17(16)23-3)25-19(22)14(2)24-15-9-5-4-6-10-15/h4-14H,1-3H3,(H,20,21)/t13-,14+/m1/s1
InChIKeyGCPVWGYSJUDKCH-KGLIPLIRSA-N
XLogP3.03
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-(4-chlorophenoxy)propanoate
CID 8866266
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2R)-2-(4-tert-butylphenoxy)propanoate
CID 8984850
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methoxyphenoxy)propanoate
CID 55518336
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
2-(3-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 19203871
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-(2,4-dichlorophenoxy)propanoate
CID 7862498
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methylphenoxy)propanoate
CID 46622069
(2S)-2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 42093263
2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 18837904
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate
CID 8842761
[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
CID 7833634
2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide
CID 17340995

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate?
The IUPAC name of [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate (CID 7833581) is [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate.
What is the SMILES notation for [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate?
The canonical SMILES for [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate is COc1ccccc1NC(=O)[C@@H](C)OC(=O)[C@H](C)Oc1ccccc1.
What is the InChIKey of [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate?
The InChIKey is GCPVWGYSJUDKCH-KGLIPLIRSA-N. The full InChI is InChI=1S/C19H21NO5/c1-13(18(21)20-16-11-7-8-12-17(16)23-3)25-19(22)14(2)24-15-9-5-4-6-10-15/h4-14H,1-3H3,(H,20,21)/t13-,14+/m1/s1.
What are the key properties of [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate?
[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate has a molecular weight of 343.38 g/mol, XLogP of 3.03, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate is sourced from PubChem (CID 7833581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).