azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone

C23H24N4O2 — CID 109071728

IUPACazepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
SMILESO=C(c1nc(C(=O)N2CCc3ccccc32)n2ccccc12)N1CCCCCC1
InChIInChI=1S/C23H24N4O2/c28-22(25-13-6-1-2-7-14-25)20-19-11-5-8-15-26(19)21(24-20)23(29)27-16-12-17-9-3-4-10-18(17)27/h3-5,8-11,15H,1-2,6-7,12-14,16H2
InChIKeyUMXDTHGACKBSOX-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.55
Rot. Bonds2

About azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone

azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone (PubChem CID 109071728) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone.

Molecular Properties

Compound Nameazepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
PubChem CID109071728
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Nameazepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
SMILESO=C(c1nc(C(=O)N2CCc3ccccc32)n2ccccc12)N1CCCCCC1
InChIInChI=1S/C23H24N4O2/c28-22(25-13-6-1-2-7-14-25)20-19-11-5-8-15-26(19)21(24-20)23(29)27-16-12-17-9-3-4-10-18(17)27/h3-5,8-11,15H,1-2,6-7,12-14,16H2
InChIKeyUMXDTHGACKBSOX-UHFFFAOYSA-N
XLogP3.55
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dihydro-1H-isoquinolin-2-yl-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 109068488
N-tert-butyl-3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071070
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
1-(2,3-dihydroindole-1-carbonyl)-N-propylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066086
1-(piperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066328
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
azepan-1-yl-[3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 109071586
3-(azepane-1-carbonyl)-N-(2-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071771
N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068496
1-(azepane-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109067029
1-(piperidine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066963

Frequently Asked Questions

What is the IUPAC name of azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The IUPAC name of azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone (CID 109071728) is azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone.
What is the SMILES notation for azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The canonical SMILES for azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone is O=C(c1nc(C(=O)N2CCc3ccccc32)n2ccccc12)N1CCCCCC1.
What is the InChIKey of azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The InChIKey is UMXDTHGACKBSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c28-22(25-13-6-1-2-7-14-25)20-19-11-5-8-15-26(19)21(24-20)23(29)27-16-12-17-9-3-4-10-18(17)27/h3-5,8-11,15H,1-2,6-7,12-14,16H2.
What are the key properties of azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone has a molecular weight of 388.47 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azepan-1-yl-[3-(2,3-dihydroindole-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone is sourced from PubChem (CID 109071728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).