2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide

C17H25NO2 — CID 65112006

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide
SMILESCCC(O)(CC)CNC(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C17H25NO2/c1-3-17(20,4-2)12-18-16(19)11-13-8-9-14-6-5-7-15(14)10-13/h8-10,20H,3-7,11-12H2,1-2H3,(H,18,19)
InChIKeyUNPPODGIRDLWJD-UHFFFAOYSA-N
MW275.39 g/mol
LogP2.39
Rot. Bonds6

About 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide

2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide (PubChem CID 65112006) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide
PubChem CID65112006
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide
SMILESCCC(O)(CC)CNC(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C17H25NO2/c1-3-17(20,4-2)12-18-16(19)11-13-8-9-14-6-5-7-15(14)10-13/h8-10,20H,3-7,11-12H2,1-2H3,(H,18,19)
InChIKeyUNPPODGIRDLWJD-UHFFFAOYSA-N
XLogP2.39
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yl)-3-hydroxy-3-methylpentan-2-one
CID 103446716
N-[2-(ethylamino)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide;hydrochloride
CID 119508424
2-(2,3-dihydro-1H-inden-5-yl)-N-propan-2-ylacetamide
CID 60645732
ethyl 4-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]butanoate
CID 60645837
2-(2,3-dihydro-1H-inden-5-yl)-N-prop-2-enylacetamide
CID 60645760
2-(2,3-dihydro-1H-inden-5-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide;hydrochloride
CID 120650056
N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 60645733
2-[[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]methyl]pentanoic acid
CID 65219085
[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-yl)acetate
CID 8567316
2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(N-methylanilino)ethyl]acetamide
CID 55447489
N-cyclopropyl-2-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 8623360
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 107845444

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide (CID 65112006) is 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide is CCC(O)(CC)CNC(=O)Cc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide?
The InChIKey is UNPPODGIRDLWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-3-17(20,4-2)12-18-16(19)11-13-8-9-14-6-5-7-15(14)10-13/h8-10,20H,3-7,11-12H2,1-2H3,(H,18,19).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide?
2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide has a molecular weight of 275.39 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide is sourced from PubChem (CID 65112006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).