2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone

C22H19NO2 — CID 4946349

IUPAC2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone
SMILESO=C(c1ccccc1OCc1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H19NO2/c24-22(23-15-14-18-10-4-6-12-20(18)23)19-11-5-7-13-21(19)25-16-17-8-2-1-3-9-17/h1-13H,14-16H2
InChIKeyYPFRNZYYZIEXNC-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.47
Rot. Bonds4

About 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone

2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone (PubChem CID 4946349) has the molecular formula C22H19NO2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone
PubChem CID4946349
Molecular FormulaC22H19NO2
Molecular Weight329.40 g/mol
Exact Mass329.14
IUPAC Name2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone
SMILESO=C(c1ccccc1OCc1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H19NO2/c24-22(23-15-14-18-10-4-6-12-20(18)23)19-11-5-7-13-21(19)25-16-17-8-2-1-3-9-17/h1-13H,14-16H2
InChIKeyYPFRNZYYZIEXNC-UHFFFAOYSA-N
XLogP4.47
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(4-chlorophenyl)methoxy]phenyl]-(2,3-dihydroindol-1-yl)methanone
CID 18205239
2,3-dihydroindol-1-yl-(3-phenylmethoxyphenyl)methanone
CID 8778658
3,4-dihydro-2H-quinolin-1-yl-[2-(2-phenoxyethoxy)phenyl]methanone
CID 4954325
2,3-dihydroindol-1-yl-[2-(oxolan-2-ylmethoxy)phenyl]methanone
CID 18103454
3,4-dihydro-2H-quinolin-1-yl-(2-methoxyphenyl)methanone
CID 903128
2,3-dihydroindol-1-yl-(2-pyrrolidin-1-ylphenyl)methanone
CID 168513032
N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
CID 108991209
3,4-dihydro-2H-quinolin-1-yl-(2-propan-2-yloxyphenyl)methanone
CID 86893884
2,3-dihydroindol-1-yl-[5-(phenoxymethyl)furan-2-yl]methanone
CID 17409583
2,3-dihydroindol-1-yl-[2-(methylideneamino)phenyl]methanone
CID 122502753
[2-[(4-chlorophenyl)methoxy]phenyl]-[5-[2-(methylamino)-1,3-thiazol-4-yl]-2,3-dihydroindol-1-yl]methanone
CID 122177129
(4-benzhydrylpiperazin-1-yl)-(2-phenylmethoxyphenyl)methanone
CID 4946404

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone (CID 4946349) is 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone is O=C(c1ccccc1OCc1ccccc1)N1CCc2ccccc21.
What is the InChIKey of 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone?
The InChIKey is YPFRNZYYZIEXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO2/c24-22(23-15-14-18-10-4-6-12-20(18)23)19-11-5-7-13-21(19)25-16-17-8-2-1-3-9-17/h1-13H,14-16H2.
What are the key properties of 2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone?
2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone has a molecular weight of 329.40 g/mol, XLogP of 4.47, 4 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-(2-phenylmethoxyphenyl)methanone is sourced from PubChem (CID 4946349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).