4H-benzo[a]quinolizine-3-carboxamide

C14H12N2O — CID 140524900

IUPAC4H-benzo[a]quinolizine-3-carboxamide
SMILESNC(=O)C1=CC=C2c3ccccc3C=CN2C1
InChIInChI=1S/C14H12N2O/c15-14(17)11-5-6-13-12-4-2-1-3-10(12)7-8-16(13)9-11/h1-8H,9H2,(H2,15,17)
InChIKeyCHEUQWCOCVZLGA-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.74
Rot. Bonds1

About 4H-benzo[a]quinolizine-3-carboxamide

4H-benzo[a]quinolizine-3-carboxamide (PubChem CID 140524900) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 4H-benzo[a]quinolizine-3-carboxamide.

Molecular Properties

Compound Name4H-benzo[a]quinolizine-3-carboxamide
PubChem CID140524900
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name4H-benzo[a]quinolizine-3-carboxamide
SMILESNC(=O)C1=CC=C2c3ccccc3C=CN2C1
InChIInChI=1S/C14H12N2O/c15-14(17)11-5-6-13-12-4-2-1-3-10(12)7-8-16(13)9-11/h1-8H,9H2,(H2,15,17)
InChIKeyCHEUQWCOCVZLGA-UHFFFAOYSA-N
XLogP1.74
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4H-benzo[a]quinolizine-3-carboxylic acid
CID 135314294
1H-isoquinolin-2-yl carbamate
CID 151878845
4H-quinolizine-3-carboxamide
CID 18755300
2-(3H-inden-1-yl)-1H-isoquinoline
CID 174459592
2-(1H-isoquinolin-2-yl)acetamide
CID 22641902
2,4-dihydro-[1,3]thiazino[4,3-a]isoquinoline
CID 152758606
3-ethyl-2-(1H-isoquinolin-2-yl)benzamide
CID 69135588
4-azatricyclo[9.4.0.03,8]pentadeca-1(15),2,5,7,9,11,13-heptaene-4-carboxamide
CID 159198332
3-benzazepine-3-carboxamide
CID 69175294
8H-isoquinolino[1,2-b]quinazoline
CID 132503377
tetracyclo[12.4.0.02,5.06,11]octadeca-1(18),2(5),6,8,10,12,14,16-octaene-3,4-dione
CID 71438939
tert-butyl pyrazino[2,1-a]isoquinoline-2-carboxylate
CID 141471372

Frequently Asked Questions

What is the IUPAC name of 4H-benzo[a]quinolizine-3-carboxamide?
The IUPAC name of 4H-benzo[a]quinolizine-3-carboxamide (CID 140524900) is 4H-benzo[a]quinolizine-3-carboxamide.
What is the SMILES notation for 4H-benzo[a]quinolizine-3-carboxamide?
The canonical SMILES for 4H-benzo[a]quinolizine-3-carboxamide is NC(=O)C1=CC=C2c3ccccc3C=CN2C1.
What is the InChIKey of 4H-benzo[a]quinolizine-3-carboxamide?
The InChIKey is CHEUQWCOCVZLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c15-14(17)11-5-6-13-12-4-2-1-3-10(12)7-8-16(13)9-11/h1-8H,9H2,(H2,15,17).
What are the key properties of 4H-benzo[a]quinolizine-3-carboxamide?
4H-benzo[a]quinolizine-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-benzo[a]quinolizine-3-carboxamide is sourced from PubChem (CID 140524900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).