pyrido[1,2-a]indole-10-carbonitrile

C13H8N2 — CID 66666977

IUPACpyrido[1,2-a]indole-10-carbonitrile
SMILESN#Cc1c2ccccc2n2ccccc12
InChIInChI=1S/C13H8N2/c14-9-11-10-5-1-2-6-12(10)15-8-4-3-7-13(11)15/h1-8H
InChIKeyQELFBOAMZHGNAV-UHFFFAOYSA-N
MW192.22 g/mol
LogP2.96
Rot. Bonds

About pyrido[1,2-a]indole-10-carbonitrile

pyrido[1,2-a]indole-10-carbonitrile (PubChem CID 66666977) has the molecular formula C13H8N2 and a molecular weight of 192.22 g/mol. Its IUPAC name is pyrido[1,2-a]indole-10-carbonitrile.

Molecular Properties

Compound Namepyrido[1,2-a]indole-10-carbonitrile
PubChem CID66666977
Molecular FormulaC13H8N2
Molecular Weight192.22 g/mol
Exact Mass192.07
IUPAC Namepyrido[1,2-a]indole-10-carbonitrile
SMILESN#Cc1c2ccccc2n2ccccc12
InChIInChI=1S/C13H8N2/c14-9-11-10-5-1-2-6-12(10)15-8-4-3-7-13(11)15/h1-8H
InChIKeyQELFBOAMZHGNAV-UHFFFAOYSA-N
XLogP2.96
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-nitro-6-oxobenzo[c]quinolizine-5-carbonitrile
CID 4738318
7-cyclopropylsulfonylpyrido[1,2-a]indole-10-carbonitrile
CID 66667800
3,6-di(carbazol-9-yl)-2-[3,6-di(carbazol-9-yl)-2-cyanophenyl]benzonitrile
CID 129313217
2,4-dimethylpyrido[2,3-b]indolizine-10-carbonitrile
CID 86288189
2-(4-chlorophenyl)-4-oxoquinolizine-1,3-dicarbonitrile
CID 2379349
4,6-di(carbazol-9-yl)-5-[2,6-di(carbazol-9-yl)-3,4,5-tricyanophenyl]benzene-1,2,3-tricarbonitrile
CID 129312900
2,3,4,6-tetra(carbazol-9-yl)-5-fluorobenzonitrile
CID 122401000
1,2-diethylindole-3-carbonitrile
CID 22689233
6,7,8,9-tetrahydropyrido[1,2-a]indole-10-carbonitrile
CID 10442668
1-methyl-[1,3]azaphospholo[1,5-a]pyridine-3-carbonitrile
CID 5325081
3-[(4-chlorophenyl)methylamino]-1-oxopyrido[1,2-c]pyrimidine-4-carbonitrile
CID 4780179
1-acetyl-2-chloroindole-3-carbonitrile
CID 67060642

Frequently Asked Questions

What is the IUPAC name of pyrido[1,2-a]indole-10-carbonitrile?
The IUPAC name of pyrido[1,2-a]indole-10-carbonitrile (CID 66666977) is pyrido[1,2-a]indole-10-carbonitrile.
What is the SMILES notation for pyrido[1,2-a]indole-10-carbonitrile?
The canonical SMILES for pyrido[1,2-a]indole-10-carbonitrile is N#Cc1c2ccccc2n2ccccc12.
What is the InChIKey of pyrido[1,2-a]indole-10-carbonitrile?
The InChIKey is QELFBOAMZHGNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8N2/c14-9-11-10-5-1-2-6-12(10)15-8-4-3-7-13(11)15/h1-8H.
What are the key properties of pyrido[1,2-a]indole-10-carbonitrile?
pyrido[1,2-a]indole-10-carbonitrile has a molecular weight of 192.22 g/mol, XLogP of 2.96, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrido[1,2-a]indole-10-carbonitrile is sourced from PubChem (CID 66666977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).