1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide

C19H21N3O2 — CID 78859744

IUPAC1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide
SMILESCC(=O)N1CCc2cc(C(=O)Nc3c(C)cc(C)nc3C)ccc21
InChIInChI=1S/C19H21N3O2/c1-11-9-12(2)20-13(3)18(11)21-19(24)16-5-6-17-15(10-16)7-8-22(17)14(4)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,24)
InChIKeyHZMIADMINOGTAO-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.17
Rot. Bonds2

About 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide

1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide (PubChem CID 78859744) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide
PubChem CID78859744
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide
SMILESCC(=O)N1CCc2cc(C(=O)Nc3c(C)cc(C)nc3C)ccc21
InChIInChI=1S/C19H21N3O2/c1-11-9-12(2)20-13(3)18(11)21-19(24)16-5-6-17-15(10-16)7-8-22(17)14(4)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,24)
InChIKeyHZMIADMINOGTAO-UHFFFAOYSA-N
XLogP3.17
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(2,3-dimethylphenyl)-2,3-dihydroindole-5-carboxamide
CID 29284026
1-acetyl-N-(3,5-dimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
CID 51265763
3,4-difluoro-N-(2,4,6-trimethyl-3-pyridinyl)benzamide
CID 78838373
1-acetyl-N-(2-morpholin-4-ylphenyl)-2,3-dihydroindole-5-carboxamide
CID 51265668
1-acetyl-N-(2-carbamoylphenyl)-2,3-dihydroindole-5-carboxamide
CID 51266821
1-acetyl-N-(3,4,5-trimethoxyphenyl)-2,3-dihydroindole-5-carboxamide
CID 34258783
1-acetyl-N-ethoxy-2,3-dihydroindole-5-carboxamide
CID 43048030
2-[4-[(1-acetyl-2,3-dihydroindole-5-carbonyl)amino]phenyl]-2-methylpropanoic acid
CID 119254151
1-(1-acetyl-2,3-dihydroindol-5-yl)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanylpropan-1-one
CID 51113371
1-acetyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2,3-dihydroindole-5-carboxamide
CID 30587992
1-acetyl-N-[(2S)-pentan-2-yl]-2,3-dihydroindole-5-carboxamide
CID 30886490
1-acetyl-N-(3-aminopropyl)-2,3-dihydroindole-5-carboxamide
CID 119259829

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide?
The IUPAC name of 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide (CID 78859744) is 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide.
What is the SMILES notation for 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide?
The canonical SMILES for 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide is CC(=O)N1CCc2cc(C(=O)Nc3c(C)cc(C)nc3C)ccc21.
What is the InChIKey of 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide?
The InChIKey is HZMIADMINOGTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-11-9-12(2)20-13(3)18(11)21-19(24)16-5-6-17-15(10-16)7-8-22(17)14(4)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,24).
What are the key properties of 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide?
1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(2,4,6-trimethyl-3-pyridinyl)-2,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 78859744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).