2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine

C12H11N3 — CID 70023103

IUPAC2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine
SMILESC1=CC2=C(N=c3ccccc3=NC2)NC1
InChIInChI=1S/C12H11N3/c1-2-6-11-10(5-1)14-8-9-4-3-7-13-12(9)15-11/h1-6,13H,7-8H2
InChIKeyOEJXIZJGRATLGJ-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.31
Rot. Bonds

About 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine

2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine (PubChem CID 70023103) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine.

Molecular Properties

Compound Name2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine
PubChem CID70023103
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine
SMILESC1=CC2=C(N=c3ccccc3=NC2)NC1
InChIInChI=1S/C12H11N3/c1-2-6-11-10(5-1)14-8-9-4-3-7-13-12(9)15-11/h1-6,13H,7-8H2
InChIKeyOEJXIZJGRATLGJ-UHFFFAOYSA-N
XLogP0.31
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine 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

3-Cyclohexa-1,5-dien-1-yl-1,2-dihydropyrazin-6-amine
CID 88985554
2,3-Dihydroquinolin-2-amine
CID 89025212
2,3,4,6-Tetrahydroquinazoline
CID 91048304
1,2-Dihydropyrimido[5,4-d][1]benzazepine-6-thione
CID 136391062
[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide
CID 142910467
N-methyl-2-[(E)-prop-1-enyl]-4H-1,3-benzodiazepin-4-amine
CID 143956412
2-(2,3,4,7-tetrahydro-1H-pyrido[2,3-b]azepin-8-yl)ethanamine
CID 143997754
spiro[1H-pyridine-2,2'-indole]
CID 156768233
4-methyl-3,7,8,9-tetrahydro-2H-cyclohepta[d]pyrimidine
CID 163399710
spiro[1H-pyrimidine-2,2'-indole]
CID 164899095
6-methyl-2,5-dihydro-1H-pyrido[2,3-b]azepine
CID 169997794
5,10a-dihydro-4aH-benzo[b][1,4]benzodiazepine
CID 173062828

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine?
The IUPAC name of 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine (CID 70023103) is 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine.
What is the SMILES notation for 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine?
The canonical SMILES for 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine is C1=CC2=C(N=c3ccccc3=NC2)NC1.
What is the InChIKey of 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine?
The InChIKey is OEJXIZJGRATLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-2-6-11-10(5-1)14-8-9-4-3-7-13-12(9)15-11/h1-6,13H,7-8H2.
What are the key properties of 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine?
2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine has a molecular weight of 197.24 g/mol, XLogP of 0.31, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-pyrido[3,2-c][1,5]benzodiazepine is sourced from PubChem (CID 70023103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).