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

C17H20N4O3 — CID 30572946

IUPAC(2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
SMILESCc1cc(NC(=O)[C@@H](C)Nc2cccc(N3CCCC3=O)c2)on1
InChIInChI=1S/C17H20N4O3/c1-11-9-15(24-20-11)19-17(23)12(2)18-13-5-3-6-14(10-13)21-8-4-7-16(21)22/h3,5-6,9-10,12,18H,4,7-8H2,1-2H3,(H,19,23)/t12-/m1/s1
InChIKeyRPUADIFFBJAKMN-GFCCVEGCSA-N
MW328.37 g/mol
LogP2.55
Rot. Bonds5

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

(2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide (PubChem CID 30572946) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide.

Molecular Properties

Compound Name(2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
PubChem CID30572946
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name(2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
SMILESCc1cc(NC(=O)[C@@H](C)Nc2cccc(N3CCCC3=O)c2)on1
InChIInChI=1S/C17H20N4O3/c1-11-9-15(24-20-11)19-17(23)12(2)18-13-5-3-6-14(10-13)21-8-4-7-16(21)22/h3,5-6,9-10,12,18H,4,7-8H2,1-2H3,(H,19,23)/t12-/m1/s1
InChIKeyRPUADIFFBJAKMN-GFCCVEGCSA-N
XLogP2.55
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,6-difluorophenyl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 51248705
(2S)-2-[3-methoxy-4-(2-oxopyrrolidin-1-yl)anilino]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 41397393
2-[3-(2-oxopyrrolidin-1-yl)anilino]-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 55434399
N-(3-nitrophenyl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 51248679
2-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 7686856
N-[(4-methylphenyl)methyl]-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 51248710
(2S)-N-(3-chlorophenyl)-2-[4-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 8967271
2-amino-N-[3-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 119290000
diethyl 2-[3-(2-oxopyrrolidin-1-yl)anilino]propanedioate
CID 71396384
(2R)-N-(2-methylphenyl)-2-[4-(2-oxopyrrolidin-1-yl)anilino]propanamide
CID 25328467
2-(azetidin-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 116677234
N-(4-methylphenyl)-N'-[3-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679439

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide?
The IUPAC name of (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide (CID 30572946) is (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide.
What is the SMILES notation for (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide?
The canonical SMILES for (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide is Cc1cc(NC(=O)[C@@H](C)Nc2cccc(N3CCCC3=O)c2)on1.
What is the InChIKey of (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide?
The InChIKey is RPUADIFFBJAKMN-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-11-9-15(24-20-11)19-17(23)12(2)18-13-5-3-6-14(10-13)21-8-4-7-16(21)22/h3,5-6,9-10,12,18H,4,7-8H2,1-2H3,(H,19,23)/t12-/m1/s1.
What are the key properties of (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide?
(2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide has a molecular weight of 328.37 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-methyl-1,2-oxazol-5-yl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide is sourced from PubChem (CID 30572946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).