(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone

C18H15N3O — CID 2980529

IUPAC(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone
SMILESCC1Cc2ccccc2N1C(=O)c1ccc2nccnc2c1
InChIInChI=1S/C18H15N3O/c1-12-10-13-4-2-3-5-17(13)21(12)18(22)14-6-7-15-16(11-14)20-9-8-19-15/h2-9,11-12H,10H2,1H3
InChIKeyRMKBWZCCJFKNFA-UHFFFAOYSA-N
MW289.34 g/mol
LogP3.22
Rot. Bonds1

About (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone

(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone (PubChem CID 2980529) has the molecular formula C18H15N3O and a molecular weight of 289.34 g/mol. Its IUPAC name is (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone.

Molecular Properties

Compound Name(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone
PubChem CID2980529
Molecular FormulaC18H15N3O
Molecular Weight289.34 g/mol
Exact Mass289.12
IUPAC Name(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone
SMILESCC1Cc2ccccc2N1C(=O)c1ccc2nccnc2c1
InChIInChI=1S/C18H15N3O/c1-12-10-13-4-2-3-5-17(13)21(12)18(22)14-6-7-15-16(11-14)20-9-8-19-15/h2-9,11-12H,10H2,1H3
InChIKeyRMKBWZCCJFKNFA-UHFFFAOYSA-N
XLogP3.22
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(Quinoxalin-6-ylcarbonyl)piperidine
CID 148184
IWR-1-endo
CID 44483163
[1-(3-Methylphenyl)-5-benzimidazolyl]-(1-piperidinyl)methanone
CID 3243760
15-Pgdh-IN-1
CID 135300446
IWR-1-exo
CID 1163034
N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
CID 20925641
3-(4-Aminophenyl)quinoxaline-5-carboxamide
CID 25218519
Indole-based 6-membered lactam, 4d
CID 44143549
4-(cyclohexylamino)-N-quinolin-3-ylbenzamide
CID 44450288
4-[methyl(nonyl)amino]-N-quinolin-3-ylbenzamide
CID 44450300
4-[methyl(octyl)amino]-N-quinolin-3-ylbenzamide
CID 44450313
4-[hexyl(methyl)amino]-N-quinolin-3-ylbenzamide
CID 44450322

Frequently Asked Questions

What is the IUPAC name of (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone?
The IUPAC name of (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone (CID 2980529) is (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone.
What is the SMILES notation for (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone?
The canonical SMILES for (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone is CC1Cc2ccccc2N1C(=O)c1ccc2nccnc2c1.
What is the InChIKey of (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone?
The InChIKey is RMKBWZCCJFKNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O/c1-12-10-13-4-2-3-5-17(13)21(12)18(22)14-6-7-15-16(11-14)20-9-8-19-15/h2-9,11-12H,10H2,1H3.
What are the key properties of (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone?
(2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone has a molecular weight of 289.34 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2,3-dihydroindol-1-yl)-quinoxalin-6-ylmethanone is sourced from PubChem (CID 2980529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).