7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one

C19H20N2O3 — CID 124877471

IUPAC7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one
SMILESCOc1cc(=O)n2c(c1C(=O)N1c3ccccc3C[C@@H]1C)CCC2
InChIInChI=1S/C19H20N2O3/c1-12-10-13-6-3-4-7-14(13)21(12)19(23)18-15-8-5-9-20(15)17(22)11-16(18)24-2/h3-4,6-7,11-12H,5,8-10H2,1-2H3/t12-/m0/s1
InChIKeySOYFLXBXRUZFGE-LBPRGKRZSA-N
MW324.38 g/mol
LogP2.39
Rot. Bonds2

About 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one

7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one (PubChem CID 124877471) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one.

Molecular Properties

Compound Name7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one
PubChem CID124877471
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one
SMILESCOc1cc(=O)n2c(c1C(=O)N1c3ccccc3C[C@@H]1C)CCC2
InChIInChI=1S/C19H20N2O3/c1-12-10-13-6-3-4-7-14(13)21(12)19(23)18-15-8-5-9-20(15)17(22)11-16(18)24-2/h3-4,6-7,11-12H,5,8-10H2,1-2H3/t12-/m0/s1
InChIKeySOYFLXBXRUZFGE-LBPRGKRZSA-N
XLogP2.39
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one with MolForge

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Related Compounds

(2,6-dimethoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 17319734
(2-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 19061805
(3-methoxynaphthalen-2-yl)-[(2S)-2-methyl-2,3-dihydroindol-1-yl]methanone
CID 26910968
(3-chloro-4-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 133184168
(3-fluoro-4-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 46819959
2-(3,4-dimethoxyphenyl)-2-methyl-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 113197671
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 92533173
4,6-dimethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyran-2-one
CID 110699372
[3-(2-methyl-2,3-dihydroindole-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-morpholin-4-ylmethanone
CID 109075403
N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
CID 108868023
[6-(azepan-1-yl)pyrimidin-4-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109355575

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one?
The IUPAC name of 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one (CID 124877471) is 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one.
What is the SMILES notation for 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one?
The canonical SMILES for 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one is COc1cc(=O)n2c(c1C(=O)N1c3ccccc3C[C@@H]1C)CCC2.
What is the InChIKey of 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one?
The InChIKey is SOYFLXBXRUZFGE-LBPRGKRZSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-12-10-13-6-3-4-7-14(13)21(12)19(23)18-15-8-5-9-20(15)17(22)11-16(18)24-2/h3-4,6-7,11-12H,5,8-10H2,1-2H3/t12-/m0/s1.
What are the key properties of 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one?
7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one has a molecular weight of 324.38 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-8-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-2,3-dihydro-1H-indolizin-5-one is sourced from PubChem (CID 124877471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).