5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide

C10H14N8O2 — CID 102742250

IUPAC5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide
SMILESCC(NC(=O)c1noc(C2CCCN2)n1)c1nn[nH]n1
InChIInChI=1S/C10H14N8O2/c1-5(7-14-17-18-15-7)12-9(19)8-13-10(20-16-8)6-3-2-4-11-6/h5-6,11H,2-4H2,1H3,(H,12,19)(H,14,15,17,18)
InChIKeyWMSOWEYPMWQHMV-UHFFFAOYSA-N
MW278.28 g/mol
LogP-0.50
Rot. Bonds4

About 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide

5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102742250) has the molecular formula C10H14N8O2 and a molecular weight of 278.28 g/mol. Its IUPAC name is 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide
PubChem CID102742250
Molecular FormulaC10H14N8O2
Molecular Weight278.28 g/mol
Exact Mass278.12
IUPAC Name5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide
SMILESCC(NC(=O)c1noc(C2CCCN2)n1)c1nn[nH]n1
InChIInChI=1S/C10H14N8O2/c1-5(7-14-17-18-15-7)12-9(19)8-13-10(20-16-8)6-3-2-4-11-6/h5-6,11H,2-4H2,1H3,(H,12,19)(H,14,15,17,18)
InChIKeyWMSOWEYPMWQHMV-UHFFFAOYSA-N
XLogP-0.50
TPSA134.51 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide with MolForge

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Related Compounds

methyl 2-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]propanoate
CID 104970945
N-(1-cyclopropylethyl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 104970833
N-(1-cyclobutylethyl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 102742553
N-[(1S)-1-pyridin-4-ylethyl]-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 102742442
N-(1-cyclohexylethyl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 104970872
(2S,3R)-3-hydroxy-2-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]butanoic acid
CID 102742599
3-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]pentanoic acid
CID 102742476
(2S)-4-amino-4-oxo-2-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]butanoic acid
CID 107824666
5-pyrrolidin-2-yl-N-(2,3,3-trimethylbutyl)-1,2,4-oxadiazole-3-carboxamide
CID 104971182
(2S)-4-hydroxy-2-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]butanoic acid
CID 107824867
N-(2-propan-2-yloxyethyl)-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 102742533
N-propyl-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 104970775

Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide (CID 102742250) is 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide is CC(NC(=O)c1noc(C2CCCN2)n1)c1nn[nH]n1.
What is the InChIKey of 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is WMSOWEYPMWQHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N8O2/c1-5(7-14-17-18-15-7)12-9(19)8-13-10(20-16-8)6-3-2-4-11-6/h5-6,11H,2-4H2,1H3,(H,12,19)(H,14,15,17,18).
What are the key properties of 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide?
5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 278.28 g/mol, XLogP of -0.50, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-2-yl-N-[1-(2H-tetrazol-5-yl)ethyl]-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102742250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).