(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone

C20H23NO5 — CID 24906207

IUPAC(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2c(c1)CC(C)N2C(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C20H23NO5/c1-12-8-13-9-15(23-2)6-7-16(13)21(12)20(22)14-10-17(24-3)19(26-5)18(11-14)25-4/h6-7,9-12H,8H2,1-5H3
InChIKeySSJRNAMTNQXJMP-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.31
Rot. Bonds5

About (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone

(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone (PubChem CID 24906207) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone.

Molecular Properties

Compound Name(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone
PubChem CID24906207
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2c(c1)CC(C)N2C(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C20H23NO5/c1-12-8-13-9-15(23-2)6-7-16(13)21(12)20(22)14-10-17(24-3)19(26-5)18(11-14)25-4/h6-7,9-12H,8H2,1-5H3
InChIKeySSJRNAMTNQXJMP-UHFFFAOYSA-N
XLogP3.31
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone
CID 28757
3,4,5-Trimethoxybenzanilide
CID 305103
3,4,5-Trimethoxy-N-(2-(4-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)benzamide
CID 25105703
(3E)-6-methoxy-3-[(3,4,5-trimethoxyphenyl)methylidene]-1H-indol-2-one
CID 11544661
1,3-benzodioxol-5-yl(2,3-dihydro-1H-indol-1-yl)methanone
CID 669591
N-(3-acetylphenyl)-3,4,5-trimethoxybenzamide
CID 692750
(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one
CID 947879
2-Methyl-1-(3,4,5-trimethoxybenzoyl)-1,2,3,4-tetrahydroquinoline
CID 2929726
p-Benzotoluidide, 3,4,5-trimethoxy-
CID 12924
4'-Dimethylamino-3,4,5-trimethoxy benzanilide
CID 43380
3,4,5-Trimethoxy-N-(4-methoxyphenyl)benzamide
CID 364715
6,7-Dimethoxy-2-(4-methoxyphenyl)isoindolin-1-one
CID 767108

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone?
The IUPAC name of (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone (CID 24906207) is (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone.
What is the SMILES notation for (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone?
The canonical SMILES for (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone is COc1ccc2c(c1)CC(C)N2C(=O)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone?
The InChIKey is SSJRNAMTNQXJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-12-8-13-9-15(23-2)6-7-16(13)21(12)20(22)14-10-17(24-3)19(26-5)18(11-14)25-4/h6-7,9-12H,8H2,1-5H3.
What are the key properties of (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone?
(5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone has a molecular weight of 357.41 g/mol, XLogP of 3.31, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-2-methyl-2,3-dihydroindol-1-yl)-(3,4,5-trimethoxyphenyl)methanone is sourced from PubChem (CID 24906207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).