2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol

C8H12N6O — CID 63940787

IUPAC2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol
SMILESCC(C)(O)CNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O/c1-8(2,15)5-10-6-3-9-4-7-11-12-13-14(6)7/h3-4,10,15H,5H2,1-2H3
InChIKeyVWYNMXRSVPFFBI-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.30
Rot. Bonds3

About 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol

2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol (PubChem CID 63940787) has the molecular formula C8H12N6O and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol
PubChem CID63940787
Molecular FormulaC8H12N6O
Molecular Weight208.22 g/mol
Exact Mass208.11
IUPAC Name2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol
SMILESCC(C)(O)CNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O/c1-8(2,15)5-10-6-3-9-4-7-11-12-13-14(6)7/h3-4,10,15H,5H2,1-2H3
InChIKeyVWYNMXRSVPFFBI-UHFFFAOYSA-N
XLogP-0.30
TPSA88.23 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol (CID 63940787) is 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol is CC(C)(O)CNc1cncc2nnnn12.
What is the InChIKey of 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol?
The InChIKey is VWYNMXRSVPFFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N6O/c1-8(2,15)5-10-6-3-9-4-7-11-12-13-14(6)7/h3-4,10,15H,5H2,1-2H3.
What are the key properties of 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol?
2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol has a molecular weight of 208.22 g/mol, XLogP of -0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol is sourced from PubChem (CID 63940787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).