1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol

C9H11N5O2 — CID 43807265

IUPAC1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
SMILESCC(O)C(N)c1nc(-c2cnccn2)no1
InChIInChI=1S/C9H11N5O2/c1-5(15)7(10)9-13-8(14-16-9)6-4-11-2-3-12-6/h2-5,7,15H,10H2,1H3
InChIKeyKACJSMLJAVJAKB-UHFFFAOYSA-N
MW221.22 g/mol
LogP-0.09
Rot. Bonds3

About 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol

1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol (PubChem CID 43807265) has the molecular formula C9H11N5O2 and a molecular weight of 221.22 g/mol. Its IUPAC name is 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
PubChem CID43807265
Molecular FormulaC9H11N5O2
Molecular Weight221.22 g/mol
Exact Mass221.09
IUPAC Name1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
SMILESCC(O)C(N)c1nc(-c2cnccn2)no1
InChIInChI=1S/C9H11N5O2/c1-5(15)7(10)9-13-8(14-16-9)6-4-11-2-3-12-6/h2-5,7,15H,10H2,1H3
InChIKeyKACJSMLJAVJAKB-UHFFFAOYSA-N
XLogP-0.09
TPSA110.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

(1R)-2-methyl-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 93298235
(1S,2S)-2-methyl-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 103832881
1-amino-1-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]propan-2-ol
CID 114876663
2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)pentan-3-ol
CID 55221009
(1S,2R)-1-amino-1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 29300337
ethyl 2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propanoate
CID 79474428
5-(1-bromopropyl)-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 62854732
1-amino-1-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 63218930
N-ethyl-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 62851367
1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)butan-2-ol
CID 63345918
2-methyl-1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 43096854
3,3-dimethyl-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)butan-2-ol
CID 63345917

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol?
The IUPAC name of 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol (CID 43807265) is 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol.
What is the SMILES notation for 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol?
The canonical SMILES for 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol is CC(O)C(N)c1nc(-c2cnccn2)no1.
What is the InChIKey of 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol?
The InChIKey is KACJSMLJAVJAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O2/c1-5(15)7(10)9-13-8(14-16-9)6-4-11-2-3-12-6/h2-5,7,15H,10H2,1H3.
What are the key properties of 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol?
1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol has a molecular weight of 221.22 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol is sourced from PubChem (CID 43807265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).