2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone

C23H23N3O — CID 109176460

IUPAC2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone
SMILESCCN(c1cccc(C)c1)c1cc(C(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C23H23N3O/c1-3-25(20-9-6-7-17(2)15-20)22-16-19(11-13-24-22)23(27)26-14-12-18-8-4-5-10-21(18)26/h4-11,13,15-16H,3,12,14H2,1-2H3
InChIKeyMGEGFIIHGZORPL-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.75
Rot. Bonds4

About 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone

2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone (PubChem CID 109176460) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone
PubChem CID109176460
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone
SMILESCCN(c1cccc(C)c1)c1cc(C(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C23H23N3O/c1-3-25(20-9-6-7-17(2)15-20)22-16-19(11-13-24-22)23(27)26-14-12-18-8-4-5-10-21(18)26/h4-11,13,15-16H,3,12,14H2,1-2H3
InChIKeyMGEGFIIHGZORPL-UHFFFAOYSA-N
XLogP4.75
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)pyrimidin-4-yl]methanone
CID 109314535
4-(2,3-dihydroindol-1-yl)-N-ethyl-N-(3-methylphenyl)pyrimidin-2-amine
CID 112902262
3,4-dihydro-1H-isoquinolin-2-yl-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]methanone
CID 109158481
2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109168022
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109091644
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
3,4-dihydro-2H-quinolin-1-yl-[6-(N-ethylanilino)pyrimidin-4-yl]methanone
CID 109356710
ethyl N-[[4-(2,3-dihydroindole-1-carbonyl)-2-pyridinyl]methyl]carbamate
CID 112532221
3-[[4-(2,3-dihydroindole-1-carbonyl)-2-pyridinyl]methyl]-1,1-dimethylurea
CID 112532223
2,3-dihydroindol-1-yl-[2-[(3-methylphenyl)methylamino]pyrimidin-5-yl]methanone
CID 109255992
4-(2,3-dihydroindole-1-carbonyl)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109091330
3,4-dihydro-2H-quinolin-1-yl-[2-(N-ethylanilino)pyrimidin-5-yl]methanone
CID 109266231

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone (CID 109176460) is 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone is CCN(c1cccc(C)c1)c1cc(C(=O)N2CCc3ccccc32)ccn1.
What is the InChIKey of 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone?
The InChIKey is MGEGFIIHGZORPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-3-25(20-9-6-7-17(2)15-20)22-16-19(11-13-24-22)23(27)26-14-12-18-8-4-5-10-21(18)26/h4-11,13,15-16H,3,12,14H2,1-2H3.
What are the key properties of 2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone?
2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone has a molecular weight of 357.46 g/mol, XLogP of 4.75, 4 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-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone is sourced from PubChem (CID 109176460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).