2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide

C20H24N2O3 — CID 110930973

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide
SMILESCN(CCO)c1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C20H24N2O3/c1-22(11-12-23)18-8-6-17(7-9-18)21-20(24)14-25-19-10-5-15-3-2-4-16(15)13-19/h5-10,13,23H,2-4,11-12,14H2,1H3,(H,21,24)
InChIKeyKMGQUGSMKODOFC-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.62
Rot. Bonds7

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide (PubChem CID 110930973) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide
PubChem CID110930973
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide
SMILESCN(CCO)c1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C20H24N2O3/c1-22(11-12-23)18-8-6-17(7-9-18)21-20(24)14-25-19-10-5-15-3-2-4-16(15)13-19/h5-10,13,23H,2-4,11-12,14H2,1H3,(H,21,24)
InChIKeyKMGQUGSMKODOFC-UHFFFAOYSA-N
XLogP2.62
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(4-tert-butylphenyl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 112978184
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 17105980
dimethyl 5-[[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2711603
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 7235167
N-[4-(azepan-1-yl)phenyl]-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 7582308
N-(1,3-benzodioxol-5-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 2709578
N-(2,3-dihydro-1H-inden-5-yl)-2-(4-methoxyphenoxy)acetamide
CID 2710612
N-(4-cyanophenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)acetamide
CID 112978228
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]acetamide
CID 9106631
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9141062
N-(2,3-dihydro-1H-inden-5-yl)-2-(4-iodophenoxy)acetamide
CID 2627640
methyl 4-[[2-[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]oxyacetyl]amino]benzoate
CID 7235156

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide (CID 110930973) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide is CN(CCO)c1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide?
The InChIKey is KMGQUGSMKODOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-22(11-12-23)18-8-6-17(7-9-18)21-20(24)14-25-19-10-5-15-3-2-4-16(15)13-19/h5-10,13,23H,2-4,11-12,14H2,1H3,(H,21,24).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide has a molecular weight of 340.42 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 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-[4-[2-hydroxyethyl(methyl)amino]phenyl]acetamide is sourced from PubChem (CID 110930973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).