N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

C21H22N4O2 — CID 109071070

IUPACN-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)(C)NC(=O)c1nc(C(=O)N2CCc3ccccc32)n2ccccc12
InChIInChI=1S/C21H22N4O2/c1-21(2,3)23-19(26)17-16-10-6-7-12-24(16)18(22-17)20(27)25-13-11-14-8-4-5-9-15(14)25/h4-10,12H,11,13H2,1-3H3,(H,23,26)
InChIKeyVVWJOLWXFQNQFA-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.07
Rot. Bonds2

About N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109071070) has the molecular formula C21H22N4O2 and a molecular weight of 362.43 g/mol. Its IUPAC name is N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109071070
Molecular FormulaC21H22N4O2
Molecular Weight362.43 g/mol
Exact Mass362.17
IUPAC NameN-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)(C)NC(=O)c1nc(C(=O)N2CCc3ccccc32)n2ccccc12
InChIInChI=1S/C21H22N4O2/c1-21(2,3)23-19(26)17-16-10-6-7-12-24(16)18(22-17)20(27)25-13-11-14-8-4-5-9-15(14)25/h4-10,12H,11,13H2,1-3H3,(H,23,26)
InChIKeyVVWJOLWXFQNQFA-UHFFFAOYSA-N
XLogP3.07
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide 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

azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 109071728
N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068496
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-[2-(dimethylamino)ethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 109069614
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(3-methoxypropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109069144
1-(2,3-dihydroindole-1-carbonyl)-N-propylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066086
1-N-tert-butyl-3-N,3-N-diethylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070965
1-N-tert-butyl-3-N-cycloheptylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071055
N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
CID 109089256
1-N-tert-butyl-3-N-methyl-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071069
N-tert-butyl-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
CID 109099143
1-N-tert-butyl-3-N-(2-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070790
1-N-tert-butyl-3-N-[4-(dimethylamino)phenyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071118

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109071070) is N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is CC(C)(C)NC(=O)c1nc(C(=O)N2CCc3ccccc32)n2ccccc12.
What is the InChIKey of N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is VVWJOLWXFQNQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O2/c1-21(2,3)23-19(26)17-16-10-6-7-12-24(16)18(22-17)20(27)25-13-11-14-8-4-5-9-15(14)25/h4-10,12H,11,13H2,1-3H3,(H,23,26).
What are the key properties of N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 362.43 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109071070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).