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

C19H17NO3 — CID 2634063

IUPAC2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone
SMILESCOc1ccc2oc(C(=O)N3CCc4ccccc43)c(C)c2c1
InChIInChI=1S/C19H17NO3/c1-12-15-11-14(22-2)7-8-17(15)23-18(12)19(21)20-10-9-13-5-3-4-6-16(13)20/h3-8,11H,9-10H2,1-2H3
InChIKeyQIRYIUJJNOZAFG-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.95
Rot. Bonds2

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

2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone (PubChem CID 2634063) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone
PubChem CID2634063
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone
SMILESCOc1ccc2oc(C(=O)N3CCc4ccccc43)c(C)c2c1
InChIInChI=1S/C19H17NO3/c1-12-15-11-14(22-2)7-8-17(15)23-18(12)19(21)20-10-9-13-5-3-4-6-16(13)20/h3-8,11H,9-10H2,1-2H3
InChIKeyQIRYIUJJNOZAFG-UHFFFAOYSA-N
XLogP3.95
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-phenyl-N-(3-(piperidin-1-yl)propyl)benzofuran-2-carboxamide
CID 71452341
5,6-dimethoxy-3-methyl-N-phenyl-N-(3-(piperidin-1-yl)propyl)benzofuran-2-carboxamide
CID 71463022
N-(2-methylphenyl)-1-benzofuran-2-carboxamide
CID 725660
1-((3-Methyl-1-benzofuran-2-YL)carbonyl)-1,2,3,4-tetrahydroquinoline
CID 888386
5-Methoxy-2-(4-dimethylaminophenyl)benzofuran
CID 11673398
Benzofuran-2-yl(indolin-1-yl)methanone
CID 780029
N-(4-pyrrolidin-1-ylphenyl)-1-benzofuran-2-carboxamide
CID 675058
N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propyl-1-benzofuran-2-carboxamide
CID 2444004
2-Methyl-1-(5-methyl-2-furoyl)indoline
CID 2971468
2,3-Dihydroindol-1-yl-[3-(methoxymethyl)-1-benzofuran-2-yl]methanone
CID 7958162
N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-1-benzofuran-2-carboxamide
CID 9119435
N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 9328527

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone (CID 2634063) is 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone is COc1ccc2oc(C(=O)N3CCc4ccccc43)c(C)c2c1.
What is the InChIKey of 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone?
The InChIKey is QIRYIUJJNOZAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-12-15-11-14(22-2)7-8-17(15)23-18(12)19(21)20-10-9-13-5-3-4-6-16(13)20/h3-8,11H,9-10H2,1-2H3.
What are the key properties of 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone?
2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone has a molecular weight of 307.35 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone is sourced from PubChem (CID 2634063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).