chromeno[3,4-b]pyrazin-5-one

C11H6N2O2 — CID 691239

IUPACchromeno[3,4-b]pyrazin-5-one
SMILESO=c1oc2ccccc2c2nccnc12
InChIInChI=1S/C11H6N2O2/c14-11-10-9(12-5-6-13-10)7-3-1-2-4-8(7)15-11/h1-6H
InChIKeyNOVNOZNKFHLMJY-UHFFFAOYSA-N
MW198.18 g/mol
LogP1.74
Rot. Bonds

About chromeno[3,4-b]pyrazin-5-one

chromeno[3,4-b]pyrazin-5-one (PubChem CID 691239) has the molecular formula C11H6N2O2 and a molecular weight of 198.18 g/mol. Its IUPAC name is chromeno[3,4-b]pyrazin-5-one.

Molecular Properties

Compound Namechromeno[3,4-b]pyrazin-5-one
PubChem CID691239
Molecular FormulaC11H6N2O2
Molecular Weight198.18 g/mol
Exact Mass198.04
IUPAC Namechromeno[3,4-b]pyrazin-5-one
SMILESO=c1oc2ccccc2c2nccnc12
InChIInChI=1S/C11H6N2O2/c14-11-10-9(12-5-6-13-10)7-3-1-2-4-8(7)15-11/h1-6H
InChIKeyNOVNOZNKFHLMJY-UHFFFAOYSA-N
XLogP1.74
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.18
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze chromeno[3,4-b]pyrazin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1]benzofuro[2,3-b]pyrazine
CID 55297119
4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
CID 142281054
1,2-dimethylchromeno[3,4-d]imidazol-4-one
CID 773639
11-oxa-3-azatricyclo[6.2.1.02,7]undeca-1,3,5,7,9-pentaene
CID 70245532
8,17-dioxaheptacyclo[22.6.6.02,7.010,15.018,23.025,30.031,36]hexatriaconta-1(31),2,4,6,10,12,14,18,20,22,24(36),25,27,29,32,34-hexadecaene-9,16-dione
CID 59760668
3,6,9,12,15-pentazatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2,4,6,8,10,12,15,17-nonaene
CID 122642394
iridium(3+);bis(phenanthro[9,10-b]pyrazine)
CID 160728362
3-(3-ethoxypropyl)chromeno[3,4-b]pyrazin-5-one
CID 171804142
7,10,19,22,32,35,44,47-octazaundecacyclo[26.22.0.03,26.05,24.06,11.012,17.018,23.030,49.031,36.037,42.043,48]pentaconta-1(28),3(26),4,6,8,10,12,14,16,18,20,22,24,29,31,33,35,37,39,41,43,45,47,49-tetracosaene-2,27-dione
CID 58731966
2-cyclopropylchromeno[4,3-d]pyrimidin-5-one
CID 154732245
3-methyl-2-pyridin-2-ylchromeno[4,3-c]pyrazol-4-one
CID 15956882
8-methylchromeno[4,3-b]pyridin-5-one
CID 159288249

Frequently Asked Questions

What is the IUPAC name of chromeno[3,4-b]pyrazin-5-one?
The IUPAC name of chromeno[3,4-b]pyrazin-5-one (CID 691239) is chromeno[3,4-b]pyrazin-5-one.
What is the SMILES notation for chromeno[3,4-b]pyrazin-5-one?
The canonical SMILES for chromeno[3,4-b]pyrazin-5-one is O=c1oc2ccccc2c2nccnc12.
What is the InChIKey of chromeno[3,4-b]pyrazin-5-one?
The InChIKey is NOVNOZNKFHLMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6N2O2/c14-11-10-9(12-5-6-13-10)7-3-1-2-4-8(7)15-11/h1-6H.
What are the key properties of chromeno[3,4-b]pyrazin-5-one?
chromeno[3,4-b]pyrazin-5-one has a molecular weight of 198.18 g/mol, XLogP of 1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chromeno[3,4-b]pyrazin-5-one is sourced from PubChem (CID 691239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).