N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide

C17H15NO3 — CID 12908981

IUPACN-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide
SMILESCC(=O)Nc1cc2c(cc1Oc1ccccc1)C(=O)CC2
InChIInChI=1S/C17H15NO3/c1-11(19)18-15-9-12-7-8-16(20)14(12)10-17(15)21-13-5-3-2-4-6-13/h2-6,9-10H,7-8H2,1H3,(H,18,19)
InChIKeyBGWKFYNMLDUDJZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.57
Rot. Bonds3

About N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide

N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide (PubChem CID 12908981) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide.

Molecular Properties

Compound NameN-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide
PubChem CID12908981
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC NameN-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide
SMILESCC(=O)Nc1cc2c(cc1Oc1ccccc1)C(=O)CC2
InChIInChI=1S/C17H15NO3/c1-11(19)18-15-9-12-7-8-16(20)14(12)10-17(15)21-13-5-3-2-4-6-13/h2-6,9-10H,7-8H2,1H3,(H,18,19)
InChIKeyBGWKFYNMLDUDJZ-UHFFFAOYSA-N
XLogP3.57
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxyimino-6-phenoxy-1,2-dihydroinden-5-yl)methanesulfonamide;N-(3-oxo-6-phenoxy-1,2-dihydroinden-5-yl)methanesulfonamide
CID 88738505
6-(2,4-difluorophenoxy)-5-(methylsulfanylamino)-2,3-dihydroinden-1-one
CID 142003228
phenoxybenzene;N-phenylacetamide
CID 174350344
N-(4-hydroxy-9,10-dioxo-2-phenoxyanthracen-1-yl)acetamide
CID 16765963
N-(3-acetamidoazulen-1-yl)acetamide
CID 86151929
1-(3-acetylphenyl)-3-(1,3-dimethyl-2-oxo-6-phenoxybenzimidazol-5-yl)urea
CID 50797454
3-phenoxy-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
CID 62730603
4-tert-butyl-N-(1,4-dimethyl-2,3-dioxo-7-phenoxyquinoxalin-6-yl)benzamide
CID 50793171
N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158
1-benzyl-3-(1,3-dimethyl-2-oxo-6-phenoxybenzimidazol-5-yl)urea
CID 50797574
N-(2-phenoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133162801
N-(5-chloro-2-phenoxyphenyl)benzamide
CID 956230

Frequently Asked Questions

What is the IUPAC name of N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide?
The IUPAC name of N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide (CID 12908981) is N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide.
What is the SMILES notation for N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide?
The canonical SMILES for N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide is CC(=O)Nc1cc2c(cc1Oc1ccccc1)C(=O)CC2.
What is the InChIKey of N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide?
The InChIKey is BGWKFYNMLDUDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-11(19)18-15-9-12-7-8-16(20)14(12)10-17(15)21-13-5-3-2-4-6-13/h2-6,9-10H,7-8H2,1H3,(H,18,19).
What are the key properties of N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide?
N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide has a molecular weight of 281.31 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxo-6-phenoxy-2,3-dihydroinden-5-yl)acetamide is sourced from PubChem (CID 12908981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).