N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide

C16H19N3O — CID 22566005

IUPACN-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide
SMILESCc1ccn2cc(C(=O)NC3CN4CCC3C4)ccc12
InChIInChI=1S/C16H19N3O/c1-11-4-7-19-9-13(2-3-15(11)19)16(20)17-14-10-18-6-5-12(14)8-18/h2-4,7,9,12,14H,5-6,8,10H2,1H3,(H,17,20)
InChIKeyTVQSBAYLSNTSGD-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.68
Rot. Bonds2

About N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide

N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide (PubChem CID 22566005) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide.

Molecular Properties

Compound NameN-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide
PubChem CID22566005
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide
SMILESCc1ccn2cc(C(=O)NC3CN4CCC3C4)ccc12
InChIInChI=1S/C16H19N3O/c1-11-4-7-19-9-13(2-3-15(11)19)16(20)17-14-10-18-6-5-12(14)8-18/h2-4,7,9,12,14H,5-6,8,10H2,1H3,(H,17,20)
InChIKeyTVQSBAYLSNTSGD-UHFFFAOYSA-N
XLogP1.68
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide?
The IUPAC name of N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide (CID 22566005) is N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide.
What is the SMILES notation for N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide?
The canonical SMILES for N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide is Cc1ccn2cc(C(=O)NC3CN4CCC3C4)ccc12.
What is the InChIKey of N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide?
The InChIKey is TVQSBAYLSNTSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-4-7-19-9-13(2-3-15(11)19)16(20)17-14-10-18-6-5-12(14)8-18/h2-4,7,9,12,14H,5-6,8,10H2,1H3,(H,17,20).
What are the key properties of N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide?
N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azabicyclo[2.2.1]heptan-3-yl)-1-methylindolizine-6-carboxamide is sourced from PubChem (CID 22566005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).