(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone

C20H21NO2 — CID 59979403

IUPAC(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone
SMILESCC=Cc1ccc2c(c1)CCN2C(=O)c1ccc(OC)cc1C
InChIInChI=1S/C20H21NO2/c1-4-5-15-6-9-19-16(13-15)10-11-21(19)20(22)18-8-7-17(23-3)12-14(18)2/h4-9,12-13H,10-11H2,1-3H3
InChIKeySBHMVAKBVUEFFE-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.24
Rot. Bonds3

About (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone

(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone (PubChem CID 59979403) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone
PubChem CID59979403
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone
SMILESCC=Cc1ccc2c(c1)CCN2C(=O)c1ccc(OC)cc1C
InChIInChI=1S/C20H21NO2/c1-4-5-15-6-9-19-16(13-15)10-11-21(19)20(22)18-8-7-17(23-3)12-14(18)2/h4-9,12-13H,10-11H2,1-3H3
InChIKeySBHMVAKBVUEFFE-UHFFFAOYSA-N
XLogP4.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(5-methoxy-2,3-dihydroindole-1-carbonyl)phenyl]ethanone
CID 122143793
(4-chlorophenyl)-(5-methoxy-2,3-dihydroindol-1-yl)methanone
CID 110714075
(5-methoxy-2,3-dihydroindol-1-yl)-phenylmethanone
CID 86659859
1-[1-(3,5-dimethoxybenzoyl)-2,3-dihydroindol-5-yl]ethanone
CID 110737350
(5-methoxy-2,3-dihydroindol-1-yl)-pyridin-4-ylmethanone
CID 52795317
2-amino-1-(5-methoxy-2,3-dihydroindol-1-yl)ethanone;hydrochloride
CID 119310079
tert-butyl 5-methoxy-2,3-dihydroindole-1-carboxylate
CID 10514762
(2,4-dimethoxyphenyl)-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]methanone
CID 34162563
1-(5-methoxy-2,3-dihydroindol-1-yl)-2-(4-methylphenyl)ethanone
CID 110714096
3-fluoro-4-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzoic acid
CID 120550731
1-(5-methoxy-2,3-dihydroindol-1-yl)-3-(methylamino)propan-1-one
CID 83624058
[5-(aminomethyl)-2,3-dihydroindol-1-yl]-(4-methoxyphenyl)methanone
CID 53212554

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone (CID 59979403) is (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone is CC=Cc1ccc2c(c1)CCN2C(=O)c1ccc(OC)cc1C.
What is the InChIKey of (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone?
The InChIKey is SBHMVAKBVUEFFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-4-5-15-6-9-19-16(13-15)10-11-21(19)20(22)18-8-7-17(23-3)12-14(18)2/h4-9,12-13H,10-11H2,1-3H3.
What are the key properties of (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone?
(4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone has a molecular weight of 307.39 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-2-methylphenyl)-(5-prop-1-enyl-2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 59979403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).