2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

C9H14N4O3 — CID 62918342

IUPAC2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN2CCC(O)C2)o1
InChIInChI=1S/C9H14N4O3/c1-6-11-12-9(16-6)10-8(15)5-13-3-2-7(14)4-13/h7,14H,2-5H2,1H3,(H,10,12,15)
InChIKeyBKTPIAKKJMDWNP-UHFFFAOYSA-N
MW226.24 g/mol
LogP-0.62
Rot. Bonds3

About 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide

2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 62918342) has the molecular formula C9H14N4O3 and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID62918342
Molecular FormulaC9H14N4O3
Molecular Weight226.24 g/mol
Exact Mass226.11
IUPAC Name2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN2CCC(O)C2)o1
InChIInChI=1S/C9H14N4O3/c1-6-11-12-9(16-6)10-8(15)5-13-3-2-7(14)4-13/h7,14H,2-5H2,1H3,(H,10,12,15)
InChIKeyBKTPIAKKJMDWNP-UHFFFAOYSA-N
XLogP-0.62
TPSA91.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 55064652
2-[3-(methylaminomethyl)pyrrolidin-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 63264474
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 115314292
2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 60972877
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 103576790
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 113284515
N-(2,6-dibromo-4-methylphenyl)-2-[(3S)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78962201
N-(2,3-dimethylphenyl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78963336
2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 115772830
2-(2,5-dimethylpiperazin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 64980675
2-[3-(methylamino)piperidin-1-yl]-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 62545628
N-(4-fluorophenyl)-2-(3-hydroxypyrrolidin-1-yl)acetamide
CID 55130773

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide (CID 62918342) is 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is Cc1nnc(NC(=O)CN2CCC(O)C2)o1.
What is the InChIKey of 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is BKTPIAKKJMDWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O3/c1-6-11-12-9(16-6)10-8(15)5-13-3-2-7(14)4-13/h7,14H,2-5H2,1H3,(H,10,12,15).
What are the key properties of 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide?
2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 226.24 g/mol, XLogP of -0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypyrrolidin-1-yl)-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 62918342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).