2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide

C18H19NO3 — CID 2091158

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C18H19NO3/c1-21-16-7-3-6-15(11-16)19-18(20)12-22-17-9-8-13-4-2-5-14(13)10-17/h3,6-11H,2,4-5,12H2,1H3,(H,19,20)
InChIKeyOPHSEGRCAUNSAJ-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.20
Rot. Bonds5

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide (PubChem CID 2091158) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide
PubChem CID2091158
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C18H19NO3/c1-21-16-7-3-6-15(11-16)19-18(20)12-22-17-9-8-13-4-2-5-14(13)10-17/h3,6-11H,2,4-5,12H2,1H3,(H,19,20)
InChIKeyOPHSEGRCAUNSAJ-UHFFFAOYSA-N
XLogP3.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide (CID 2091158) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2ccc3c(c2)CCC3)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide?
The InChIKey is OPHSEGRCAUNSAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-21-16-7-3-6-15(11-16)19-18(20)12-22-17-9-8-13-4-2-5-14(13)10-17/h3,6-11H,2,4-5,12H2,1H3,(H,19,20).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide has a molecular weight of 297.35 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 2091158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).