4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one

C7H10N4O2 — CID 121207759

IUPAC4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one
SMILESCN1CC(c2nnc(N)o2)CC1=O
InChIInChI=1S/C7H10N4O2/c1-11-3-4(2-5(11)12)6-9-10-7(8)13-6/h4H,2-3H2,1H3,(H2,8,10)
InChIKeyJFWSNSYYHRPDPT-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.40
Rot. Bonds1

About 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one

4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one (PubChem CID 121207759) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one
PubChem CID121207759
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one
SMILESCN1CC(c2nnc(N)o2)CC1=O
InChIInChI=1S/C7H10N4O2/c1-11-3-4(2-5(11)12)6-9-10-7(8)13-6/h4H,2-3H2,1H3,(H2,8,10)
InChIKeyJFWSNSYYHRPDPT-UHFFFAOYSA-N
XLogP-0.40
TPSA85.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-amino-1,3,4-oxadiazol-2-yl)-1-cyclopropylpyrrolidin-2-one
CID 121207760
4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one
CID 136533794
5-[(1R,3R)-3-methylcyclopentyl]-1,3,4-oxadiazol-2-amine
CID 125427191
(4R)-4-(6-amino-5-bromo-3-pyridinyl)-1-methylpyrrolidin-2-one
CID 125488930
tert-butyl 4-(5-amino-1,3,4-oxadiazol-2-yl)piperidine-1-carboxylate
CID 95566122
4-(6-amino-2-pyridinyl)-1-methylpyrrolidin-2-one
CID 172723716
4-amino-1-methylpyrrolidin-2-one;ethane
CID 145355415
1-methyl-5-oxopyrrolidine-3-carboxamide
CID 541476
5-(2-methyloxolan-3-yl)-1,3,4-oxadiazol-2-amine
CID 79760347
4-[(5-amino-1,3,4-oxadiazol-2-yl)amino]-1-methylpyrazolidin-3-one
CID 130921644
[4-(5-amino-1,3,4-oxadiazol-2-yl)piperidin-1-yl]-(4-fluoro-3,5-dimethylphenyl)methanone
CID 126834348
(4S)-1-methyl-4-phenylpyrrolidin-2-one
CID 67575934

Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one?
The IUPAC name of 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one (CID 121207759) is 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one.
What is the SMILES notation for 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one?
The canonical SMILES for 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one is CN1CC(c2nnc(N)o2)CC1=O.
What is the InChIKey of 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one?
The InChIKey is JFWSNSYYHRPDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-11-3-4(2-5(11)12)6-9-10-7(8)13-6/h4H,2-3H2,1H3,(H2,8,10).
What are the key properties of 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one?
4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one has a molecular weight of 182.18 g/mol, XLogP of -0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one is sourced from PubChem (CID 121207759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).