(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one

C16H20N4O2 — CID 97202496

IUPAC(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one
SMILESCCCc1nnc(N[C@@H]2CC(=O)N(c3cccc(C)c3)C2)o1
InChIInChI=1S/C16H20N4O2/c1-3-5-14-18-19-16(22-14)17-12-9-15(21)20(10-12)13-7-4-6-11(2)8-13/h4,6-8,12H,3,5,9-10H2,1-2H3,(H,17,19)/t12-/m1/s1
InChIKeyLZRASMVWGHHYFG-GFCCVEGCSA-N
MW300.36 g/mol
LogP2.55
Rot. Bonds5

About (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one

(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one (PubChem CID 97202496) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one
PubChem CID97202496
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one
SMILESCCCc1nnc(N[C@@H]2CC(=O)N(c3cccc(C)c3)C2)o1
InChIInChI=1S/C16H20N4O2/c1-3-5-14-18-19-16(22-14)17-12-9-15(21)20(10-12)13-7-4-6-11(2)8-13/h4,6-8,12H,3,5,9-10H2,1-2H3,(H,17,19)/t12-/m1/s1
InChIKeyLZRASMVWGHHYFG-GFCCVEGCSA-N
XLogP2.55
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one with MolForge

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Related Compounds

2-(3-methyl-1,2-oxazol-5-yl)-N-[1-(3-methylphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 91768696
4-(bromomethyl)-1-(3-methylphenyl)pyrrolidin-2-one
CID 168504686
2-[2-[[(3R)-1-(3-methylphenyl)-5-oxopyrrolidin-3-yl]amino]pyrimidin-4-yl]pyridine-4-carboxylic acid
CID 95863245
1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17120547
2-(3-methylphenyl)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7254986
(4R)-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-methylphenyl)pyrrolidin-2-one
CID 51894123
N-[5-[1-(3-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]butanamide
CID 17203961
(3R)-N-methyl-1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 28892198
(4R)-4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3-methylphenyl)pyrrolidin-2-one
CID 51604276
N-[(3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-3-methylbenzamide
CID 7547623
(3R)-1-(3-methylphenyl)-5-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyrrolidine-3-carboxamide
CID 93017593
3-methyl-N-[5-[(3R)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]benzamide
CID 92893088

Frequently Asked Questions

What is the IUPAC name of (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one?
The IUPAC name of (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one (CID 97202496) is (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one?
The canonical SMILES for (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one is CCCc1nnc(N[C@@H]2CC(=O)N(c3cccc(C)c3)C2)o1.
What is the InChIKey of (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one?
The InChIKey is LZRASMVWGHHYFG-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-3-5-14-18-19-16(22-14)17-12-9-15(21)20(10-12)13-7-4-6-11(2)8-13/h4,6-8,12H,3,5,9-10H2,1-2H3,(H,17,19)/t12-/m1/s1.
What are the key properties of (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one?
(4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one has a molecular weight of 300.36 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(3-methylphenyl)-4-[(5-propyl-1,3,4-oxadiazol-2-yl)amino]pyrrolidin-2-one is sourced from PubChem (CID 97202496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).