2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide

C21H22N2O4 — CID 51116652

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide
SMILESO=C(COc1ccc2c(c1)CCC2)Nc1cccc(CN2CCOC2=O)c1
InChIInChI=1S/C21H22N2O4/c24-20(14-27-19-8-7-16-4-2-5-17(16)12-19)22-18-6-1-3-15(11-18)13-23-9-10-26-21(23)25/h1,3,6-8,11-12H,2,4-5,9-10,13-14H2,(H,22,24)
InChIKeyXJYICBBMDGPLNO-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.14
Rot. Bonds6

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide (PubChem CID 51116652) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide
PubChem CID51116652
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide
SMILESO=C(COc1ccc2c(c1)CCC2)Nc1cccc(CN2CCOC2=O)c1
InChIInChI=1S/C21H22N2O4/c24-20(14-27-19-8-7-16-4-2-5-17(16)12-19)22-18-6-1-3-15(11-18)13-23-9-10-26-21(23)25/h1,3,6-8,11-12H,2,4-5,9-10,13-14H2,(H,22,24)
InChIKeyXJYICBBMDGPLNO-UHFFFAOYSA-N
XLogP3.14
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-fluorophenyl)acetamide
CID 2611402
N-(1,3-benzodioxol-5-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 2709578
N-[3-[(3-cyanophenyl)methoxy]phenyl]-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 55689140
2-(2,3-dihydro-1H-inden-5-yloxy)-N-pyridin-3-ylacetamide
CID 2506082
2-(4-fluorophenoxy)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetamide
CID 39140496
3-(2,3-dichlorophenyl)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide
CID 47042427
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-imidazol-1-ylphenyl)acetamide
CID 51118112
N-[4-(azepan-1-yl)phenyl]-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 7582308
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
CID 4882205
[2-(3-chloroanilino)-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 4803026
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 19458923
N-(2,6-difluorophenyl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 51139353

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide (CID 51116652) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide is O=C(COc1ccc2c(c1)CCC2)Nc1cccc(CN2CCOC2=O)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide?
The InChIKey is XJYICBBMDGPLNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c24-20(14-27-19-8-7-16-4-2-5-17(16)12-19)22-18-6-1-3-15(11-18)13-23-9-10-26-21(23)25/h1,3,6-8,11-12H,2,4-5,9-10,13-14H2,(H,22,24).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide has a molecular weight of 366.42 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]acetamide is sourced from PubChem (CID 51116652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).