indolo[3,2-d][1]benzazepine-9-carbonitrile

C17H9N3 — CID 139963449

IUPACindolo[3,2-d][1]benzazepine-9-carbonitrile
SMILESN#Cc1ccc2nc3c4ccccc4nccc-3c2c1
InChIInChI=1S/C17H9N3/c18-10-11-5-6-16-14(9-11)12-7-8-19-15-4-2-1-3-13(15)17(12)20-16/h1-9H
InChIKeyMVWHADCWDSKZNZ-UHFFFAOYSA-N
MW255.28 g/mol
LogP3.76
Rot. Bonds

About indolo[3,2-d][1]benzazepine-9-carbonitrile

indolo[3,2-d][1]benzazepine-9-carbonitrile (PubChem CID 139963449) has the molecular formula C17H9N3 and a molecular weight of 255.28 g/mol. Its IUPAC name is indolo[3,2-d][1]benzazepine-9-carbonitrile.

Molecular Properties

Compound Nameindolo[3,2-d][1]benzazepine-9-carbonitrile
PubChem CID139963449
Molecular FormulaC17H9N3
Molecular Weight255.28 g/mol
Exact Mass255.08
IUPAC Nameindolo[3,2-d][1]benzazepine-9-carbonitrile
SMILESN#Cc1ccc2nc3c4ccccc4nccc-3c2c1
InChIInChI=1S/C17H9N3/c18-10-11-5-6-16-14(9-11)12-7-8-19-15-4-2-1-3-13(15)17(12)20-16/h1-9H
InChIKeyMVWHADCWDSKZNZ-UHFFFAOYSA-N
XLogP3.76
TPSA49.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze indolo[3,2-d][1]benzazepine-9-carbonitrile 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

quinoxalino[3,2-f][1,10]phenanthroline-11-carbonitrile
CID 91283468
3,4-bis[3-(2-phenylquinazolin-4-yl)phenyl]benzonitrile
CID 169297045
4-(quinolin-4-ylamino)benzonitrile
CID 50877162
4-[4-(4-fluorophenyl)-1-hydroxy-5-quinolin-4-ylimidazol-2-yl]-3-methylbenzonitrile
CID 10136916
3-chloro-4-(quinolin-4-ylmethoxy)benzonitrile
CID 79230623
4-methyl-5-quinolin-4-yl-1,3-thiazole-2-carbonitrile
CID 21275463
4-(propan-2-ylamino)quinoline-6-carbonitrile
CID 146403404
2,5-di(quinolin-4-yl)-1,3,4-oxadiazole
CID 143438590
benzo[c]cinnoline-3-carbonitrile
CID 169092864
2-[3-[12-[3-(4-cyano-2-pyridinyl)phenyl]chrysen-6-yl]phenyl]pyridine-4-carbonitrile
CID 118398063
4-[4-[2-[4-[4,6-bis(4-cyanophenyl)-1,3,5-triazin-2-yl]phenyl]-2-adamantyl]phenyl]quinoline-6-carbonitrile
CID 164938856
4-naphthalen-2-ylquinoline
CID 14173372

Frequently Asked Questions

What is the IUPAC name of indolo[3,2-d][1]benzazepine-9-carbonitrile?
The IUPAC name of indolo[3,2-d][1]benzazepine-9-carbonitrile (CID 139963449) is indolo[3,2-d][1]benzazepine-9-carbonitrile.
What is the SMILES notation for indolo[3,2-d][1]benzazepine-9-carbonitrile?
The canonical SMILES for indolo[3,2-d][1]benzazepine-9-carbonitrile is N#Cc1ccc2nc3c4ccccc4nccc-3c2c1.
What is the InChIKey of indolo[3,2-d][1]benzazepine-9-carbonitrile?
The InChIKey is MVWHADCWDSKZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9N3/c18-10-11-5-6-16-14(9-11)12-7-8-19-15-4-2-1-3-13(15)17(12)20-16/h1-9H.
What are the key properties of indolo[3,2-d][1]benzazepine-9-carbonitrile?
indolo[3,2-d][1]benzazepine-9-carbonitrile has a molecular weight of 255.28 g/mol, XLogP of 3.76, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for indolo[3,2-d][1]benzazepine-9-carbonitrile is sourced from PubChem (CID 139963449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).