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

C18H15NO2 — CID 1247770

IUPAC2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone
SMILESCc1c(C(=O)N2CCc3ccccc32)oc2ccccc12
InChIInChI=1S/C18H15NO2/c1-12-14-7-3-5-9-16(14)21-17(12)18(20)19-11-10-13-6-2-4-8-15(13)19/h2-9H,10-11H2,1H3
InChIKeyLOQUVEWCPHKFJK-UHFFFAOYSA-N
MW277.32 g/mol
LogP3.94
Rot. Bonds1

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

2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone (PubChem CID 1247770) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone
PubChem CID1247770
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone
SMILESCc1c(C(=O)N2CCc3ccccc32)oc2ccccc12
InChIInChI=1S/C18H15NO2/c1-12-14-7-3-5-9-16(14)21-17(12)18(20)19-11-10-13-6-2-4-8-15(13)19/h2-9H,10-11H2,1H3
InChIKeyLOQUVEWCPHKFJK-UHFFFAOYSA-N
XLogP3.94
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetylphenyl)-1-benzofuran-2-carboxamide
CID 675185
N-(4-fluorophenyl)-1-benzofuran-2-carboxamide
CID 725640
N-(4-methylphenyl)-1-benzofuran-2-carboxamide
CID 725663
4-((3-Methyl-1-benzofuran-2-YL)carbonyl)morpholine
CID 768761
N-(1-phenylethyl)-1-benzofuran-2-carboxamide
CID 2788390
N-(2-Benzoyl-3-benzofuranyl)acetamide
CID 616884
N-[2-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide
CID 725651
N-[4-(5-{[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl}furan-2-yl)phenyl]-1-benzofuran-2-carboxamide
CID 44182307
3-methyl-N-phenyl-N-(3-(piperidin-1-yl)propyl)benzofuran-2-carboxamide
CID 71452341
N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)benzofuran-2-carboxamide
CID 10092819
N-[4-[4-(3-Cyanophenyl)piperazin-1-yl]butyl]benzo[b]furan-2-carboxamide
CID 11596521
N-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-1-benzofuran-2-carboxamide
CID 57873531

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone (CID 1247770) is 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone is Cc1c(C(=O)N2CCc3ccccc32)oc2ccccc12.
What is the InChIKey of 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone?
The InChIKey is LOQUVEWCPHKFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-12-14-7-3-5-9-16(14)21-17(12)18(20)19-11-10-13-6-2-4-8-15(13)19/h2-9H,10-11H2,1H3.
What are the key properties of 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone?
2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone has a molecular weight of 277.32 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-(3-methyl-1-benzofuran-2-yl)methanone is sourced from PubChem (CID 1247770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).