N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide

C12H13N5O2 — CID 45370232

IUPACN-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide
SMILESO=C(NC1CCCC1)c1nc(-c2cnccn2)no1
InChIInChI=1S/C12H13N5O2/c18-11(15-8-3-1-2-4-8)12-16-10(17-19-12)9-7-13-5-6-14-9/h5-8H,1-4H2,(H,15,18)
InChIKeyNIJOCCOHIAXHGU-UHFFFAOYSA-N
MW259.27 g/mol
LogP1.20
Rot. Bonds3

About N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide

N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide (PubChem CID 45370232) has the molecular formula C12H13N5O2 and a molecular weight of 259.27 g/mol. Its IUPAC name is N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide
PubChem CID45370232
Molecular FormulaC12H13N5O2
Molecular Weight259.27 g/mol
Exact Mass259.11
IUPAC NameN-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide
SMILESO=C(NC1CCCC1)c1nc(-c2cnccn2)no1
InChIInChI=1S/C12H13N5O2/c18-11(15-8-3-1-2-4-8)12-16-10(17-19-12)9-7-13-5-6-14-9/h5-8H,1-4H2,(H,15,18)
InChIKeyNIJOCCOHIAXHGU-UHFFFAOYSA-N
XLogP1.20
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-cyclohexyl-3-[(3S,5S)-1-methyl-5-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]urea
CID 28960641
N-[(4-methoxyphenyl)methyl]-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide
CID 45369782
N-cyclopentyl-3-[4-(4-methylpiperidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
CID 50827804
N-cycloheptyl-3-(3-methylphenyl)-1,2,4-oxadiazole-5-carboxamide
CID 6471248
3-[2-(azepan-1-yl)-4-pyridinyl]-N-cyclohexyl-1,2,4-oxadiazole-5-carboxamide
CID 53175294
N-cycloheptyl-3-(2-piperidin-1-yl-4-pyridinyl)-1,2,4-oxadiazole-5-carboxamide
CID 53175164
N-cyclopentyl-3-(1H-indol-3-yl)-1,2,4-oxadiazole-5-carboxamide
CID 135636045
N-cycloheptyl-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide
CID 42570665
N-cyclopentylpyridine-3-carboxamide
CID 805532
N-cyclohexyl-4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91923540
N-cyclopentyl-3-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1,2,4-oxadiazole-5-carboxamide
CID 53205246
(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methanol
CID 63758301

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide?
The IUPAC name of N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide (CID 45370232) is N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide is O=C(NC1CCCC1)c1nc(-c2cnccn2)no1.
What is the InChIKey of N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide?
The InChIKey is NIJOCCOHIAXHGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O2/c18-11(15-8-3-1-2-4-8)12-16-10(17-19-12)9-7-13-5-6-14-9/h5-8H,1-4H2,(H,15,18).
What are the key properties of N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide?
N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide has a molecular weight of 259.27 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-pyrazin-2-yl-1,2,4-oxadiazole-5-carboxamide is sourced from PubChem (CID 45370232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).