2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone

C20H25N3O — CID 109241027

IUPAC2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone
SMILESCCCN(CCC)c1cncc(C(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C20H25N3O/c1-3-10-22(11-4-2)18-13-17(14-21-15-18)20(24)23-12-9-16-7-5-6-8-19(16)23/h5-8,13-15H,3-4,9-12H2,1-2H3
InChIKeyREPZETNEJKEUSU-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.91
Rot. Bonds6

About 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone

2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone (PubChem CID 109241027) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone
PubChem CID109241027
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone
SMILESCCCN(CCC)c1cncc(C(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C20H25N3O/c1-3-10-22(11-4-2)18-13-17(14-21-15-18)20(24)23-12-9-16-7-5-6-8-19(16)23/h5-8,13-15H,3-4,9-12H2,1-2H3
InChIKeyREPZETNEJKEUSU-UHFFFAOYSA-N
XLogP3.91
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[5-[benzyl(propan-2-yl)amino]-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109239741
2,3-dihydroindol-1-yl-[5-(pentylamino)-3-pyridinyl]methanone
CID 109240141
[5-(butan-2-ylamino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109225396
2,3-dihydroindol-1-yl-[5-(4-methylpiperazin-1-yl)-3-pyridinyl]methanone
CID 109230309
[5-(cyclopropylamino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109223844
2,3-dihydroindol-1-yl-[5-(3,5-dimethylanilino)-3-pyridinyl]methanone
CID 109242381
2,3-dihydroindol-1-yl-[5-(2-methoxyethylamino)-3-pyridinyl]methanone
CID 109227903
4-[5-(2,3-dihydroindole-1-carbonyl)-3-pyridinyl]piperazine-1-carbaldehyde
CID 109230932
2,3-dihydroindol-1-yl-[5-(pyridin-4-ylmethylamino)-3-pyridinyl]methanone
CID 109235678
[2-[benzyl(ethyl)amino]pyrimidin-5-yl]-(2,3-dihydroindol-1-yl)methanone
CID 109258457
3,4-dihydro-2H-quinolin-1-yl-[5-[3-(dimethylamino)propylamino]-3-pyridinyl]methanone
CID 109229964
3,4-dihydro-2H-quinolin-1-yl-[5-(4-ethylpiperazin-1-yl)-3-pyridinyl]methanone
CID 109230630

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone (CID 109241027) is 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone is CCCN(CCC)c1cncc(C(=O)N2CCc3ccccc32)c1.
What is the InChIKey of 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone?
The InChIKey is REPZETNEJKEUSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-3-10-22(11-4-2)18-13-17(14-21-15-18)20(24)23-12-9-16-7-5-6-8-19(16)23/h5-8,13-15H,3-4,9-12H2,1-2H3.
What are the key properties of 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone?
2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone has a molecular weight of 323.44 g/mol, XLogP of 3.91, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-[5-(dipropylamino)-3-pyridinyl]methanone is sourced from PubChem (CID 109241027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).