1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol

C9H12N4O — CID 83442636

IUPAC1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol
SMILESNCC(O)Cc1ncc2cnccn12
InChIInChI=1S/C9H12N4O/c10-4-8(14)3-9-12-6-7-5-11-1-2-13(7)9/h1-2,5-6,8,14H,3-4,10H2
InChIKeyYHHLVCRIHBDODB-UHFFFAOYSA-N
MW192.22 g/mol
LogP-0.41
Rot. Bonds3

About 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol

1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol (PubChem CID 83442636) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol
PubChem CID83442636
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol
SMILESNCC(O)Cc1ncc2cnccn12
InChIInChI=1S/C9H12N4O/c10-4-8(14)3-9-12-6-7-5-11-1-2-13(7)9/h1-2,5-6,8,14H,3-4,10H2
InChIKeyYHHLVCRIHBDODB-UHFFFAOYSA-N
XLogP-0.41
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol?
The IUPAC name of 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol (CID 83442636) is 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol.
What is the SMILES notation for 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol?
The canonical SMILES for 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol is NCC(O)Cc1ncc2cnccn12.
What is the InChIKey of 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol?
The InChIKey is YHHLVCRIHBDODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c10-4-8(14)3-9-12-6-7-5-11-1-2-13(7)9/h1-2,5-6,8,14H,3-4,10H2.
What are the key properties of 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol?
1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol has a molecular weight of 192.22 g/mol, XLogP of -0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-imidazo[1,5-a]pyrazin-3-ylpropan-2-ol is sourced from PubChem (CID 83442636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).