1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide

C21H20N4O2 — CID 109067100

IUPAC1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
SMILESC=CCNC(=O)c1nc(C(=O)N2c3ccccc3CC2C)c2ccccn12
InChIInChI=1S/C21H20N4O2/c1-3-11-22-20(26)19-23-18(17-10-6-7-12-24(17)19)21(27)25-14(2)13-15-8-4-5-9-16(15)25/h3-10,12,14H,1,11,13H2,2H3,(H,22,26)
InChIKeyRPMGGRARXVFBQX-UHFFFAOYSA-N
MW360.42 g/mol
LogP2.84
Rot. Bonds4

About 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide

1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109067100) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109067100
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
SMILESC=CCNC(=O)c1nc(C(=O)N2c3ccccc3CC2C)c2ccccn12
InChIInChI=1S/C21H20N4O2/c1-3-11-22-20(26)19-23-18(17-10-6-7-12-24(17)19)21(27)25-14(2)13-15-8-4-5-9-16(15)25/h3-10,12,14H,1,11,13H2,2H3,(H,22,26)
InChIKeyRPMGGRARXVFBQX-UHFFFAOYSA-N
XLogP2.84
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066461
1-(azepane-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109067029
1-N-(4-methylphenyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067033
1-N-(3-methoxypropyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066968
1-N-(2-methylphenyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067031
3-N-[(4-methylphenyl)methyl]-1-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066823
1-N-prop-2-enyl-3-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066836
1-N-(3-phenylpropyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067017
3-(4-formylpiperazine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-1-carboxamide
CID 109066817
methyl 4-[[1-(prop-2-enylcarbamoyl)imidazo[1,5-a]pyridine-3-carbonyl]amino]benzoate
CID 109066929
3-N-[2-(4-methoxyphenyl)ethyl]-1-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066843
methyl 2-[[3-(prop-2-enylcarbamoyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 109067086

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide (CID 109067100) is 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide is C=CCNC(=O)c1nc(C(=O)N2c3ccccc3CC2C)c2ccccn12.
What is the InChIKey of 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is RPMGGRARXVFBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-3-11-22-20(26)19-23-18(17-10-6-7-12-24(17)19)21(27)25-14(2)13-15-8-4-5-9-16(15)25/h3-10,12,14H,1,11,13H2,2H3,(H,22,26).
What are the key properties of 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide?
1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 360.42 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109067100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).