7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid

C10H10N4O3 — CID 96597293

IUPAC7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
SMILESO=C(O)c1ncn2c1CN(c1cnoc1)CC2
InChIInChI=1S/C10H10N4O3/c15-10(16)9-8-4-13(7-3-12-17-5-7)1-2-14(8)6-11-9/h3,5-6H,1-2,4H2,(H,15,16)
InChIKeyZREWVHOQVKJVDU-UHFFFAOYSA-N
MW234.22 g/mol
LogP0.59
Rot. Bonds2

About 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid

7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid (PubChem CID 96597293) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid.

Molecular Properties

Compound Name7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
PubChem CID96597293
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Name7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
SMILESO=C(O)c1ncn2c1CN(c1cnoc1)CC2
InChIInChI=1S/C10H10N4O3/c15-10(16)9-8-4-13(7-3-12-17-5-7)1-2-14(8)6-11-9/h3,5-6H,1-2,4H2,(H,15,16)
InChIKeyZREWVHOQVKJVDU-UHFFFAOYSA-N
XLogP0.59
TPSA84.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-(1,3-oxazol-2-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 96597290
7-(3-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 115003543
7-(4-methylpentanoyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 115273264
6,7,8,9-tetrahydro-5H-imidazo[1,5-d][1,4]diazepine-1-carboxylic acid
CID 82408488
7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
CID 105438527
7-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxamide
CID 170574690
2,5-dimethyl-1-(1,2-oxazol-4-yl)pyrrole-3-carboxylic acid
CID 62902400
6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 170562180
1-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylic acid
CID 151869639
6-(3-amino-2-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 170562199
3-amino-7-oxa-1,4,5,11-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9,11-tetraene-10-carboxylic acid
CID 96607593
12-methyl-8-oxa-2,4,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(13),3,5,9,11-pentaene-5-carboxylic acid
CID 96599259

Frequently Asked Questions

What is the IUPAC name of 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid?
The IUPAC name of 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid (CID 96597293) is 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid.
What is the SMILES notation for 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid?
The canonical SMILES for 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid is O=C(O)c1ncn2c1CN(c1cnoc1)CC2.
What is the InChIKey of 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid?
The InChIKey is ZREWVHOQVKJVDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c15-10(16)9-8-4-13(7-3-12-17-5-7)1-2-14(8)6-11-9/h3,5-6H,1-2,4H2,(H,15,16).
What are the key properties of 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid?
7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid has a molecular weight of 234.22 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid is sourced from PubChem (CID 96597293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).