pyrrolo[1,2-c][1,2,3]benzotriazine

C10H7N3 — CID 70352768

IUPACpyrrolo[1,2-c][1,2,3]benzotriazine
SMILESc1ccc2c(c1)nnn1cccc21
InChIInChI=1S/C10H7N3/c1-2-5-9-8(4-1)10-6-3-7-13(10)12-11-9/h1-7H
InChIKeyCAMMJEXRQPBEMY-UHFFFAOYSA-N
MW169.19 g/mol
LogP1.88
Rot. Bonds

About pyrrolo[1,2-c][1,2,3]benzotriazine

pyrrolo[1,2-c][1,2,3]benzotriazine (PubChem CID 70352768) has the molecular formula C10H7N3 and a molecular weight of 169.19 g/mol. Its IUPAC name is pyrrolo[1,2-c][1,2,3]benzotriazine.

Molecular Properties

Compound Namepyrrolo[1,2-c][1,2,3]benzotriazine
PubChem CID70352768
Molecular FormulaC10H7N3
Molecular Weight169.19 g/mol
Exact Mass169.06
IUPAC Namepyrrolo[1,2-c][1,2,3]benzotriazine
SMILESc1ccc2c(c1)nnn1cccc21
InChIInChI=1S/C10H7N3/c1-2-5-9-8(4-1)10-6-3-7-13(10)12-11-9/h1-7H
InChIKeyCAMMJEXRQPBEMY-UHFFFAOYSA-N
XLogP1.88
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze pyrrolo[1,2-c][1,2,3]benzotriazine 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

pyrazolo[1,5-c][1,2,3]benzotriazine
CID 134916177
tris(benzotriazol-1-yl)borane
CID 101187740
1-(triazolo[1,5-a]pyridin-3-yl)ethanol
CID 84651589
3-bromo-1,2,3-benzotriazin-4-one
CID 141391394
CID 68739763
CID 68739763
argon;1-hydroxybenzotriazole
CID 87516361
azanium 1-oxidobenzotriazole
CID 23118068
1-methylsulfonylbenzotriazole
CID 792044
1-phenylselanylbenzotriazole
CID 15266979
copper;tetrakis(1-methylbenzotriazole);hydrate
CID 5259674
1-(aziridin-1-yl)benzotriazole
CID 137470324
benzotriazol-1-yl(trimethyl)stannane
CID 165357783

Frequently Asked Questions

What is the IUPAC name of pyrrolo[1,2-c][1,2,3]benzotriazine?
The IUPAC name of pyrrolo[1,2-c][1,2,3]benzotriazine (CID 70352768) is pyrrolo[1,2-c][1,2,3]benzotriazine.
What is the SMILES notation for pyrrolo[1,2-c][1,2,3]benzotriazine?
The canonical SMILES for pyrrolo[1,2-c][1,2,3]benzotriazine is c1ccc2c(c1)nnn1cccc21.
What is the InChIKey of pyrrolo[1,2-c][1,2,3]benzotriazine?
The InChIKey is CAMMJEXRQPBEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3/c1-2-5-9-8(4-1)10-6-3-7-13(10)12-11-9/h1-7H.
What are the key properties of pyrrolo[1,2-c][1,2,3]benzotriazine?
pyrrolo[1,2-c][1,2,3]benzotriazine has a molecular weight of 169.19 g/mol, XLogP of 1.88, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolo[1,2-c][1,2,3]benzotriazine is sourced from PubChem (CID 70352768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).