3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide

C15H21NO3 — CID 63090874

IUPAC3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCOc1cccc2c1CCC2O
InChIInChI=1S/C15H21NO3/c1-10(2)16-15(18)8-9-19-14-5-3-4-11-12(14)6-7-13(11)17/h3-5,10,13,17H,6-9H2,1-2H3,(H,16,18)
InChIKeySLYNZIQBUGUNLH-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.96
Rot. Bonds5

About 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide

3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide (PubChem CID 63090874) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide
PubChem CID63090874
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCOc1cccc2c1CCC2O
InChIInChI=1S/C15H21NO3/c1-10(2)16-15(18)8-9-19-14-5-3-4-11-12(14)6-7-13(11)17/h3-5,10,13,17H,6-9H2,1-2H3,(H,16,18)
InChIKeySLYNZIQBUGUNLH-UHFFFAOYSA-N
XLogP1.96
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide
CID 55179521
2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-pentan-3-ylacetamide
CID 63089490
2-[(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]-N-pentan-2-ylacetamide
CID 60623659
4-[(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]-N,N-dimethylbutanamide
CID 65454087
N-cyclopropyl-2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]acetamide
CID 63091231
N-ethyl-3-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide
CID 63091539
4-[2-(2-hydroxyethoxy)ethoxy]-2,3-dihydro-1H-inden-1-ol
CID 55179905
4-but-3-ynoxy-2,3-dihydro-1H-inden-1-ol
CID 63091221
4-(3-phenylpropoxy)-2,3-dihydro-1H-inden-1-ol
CID 63091389
(1R)-4-(cyclopropylmethoxy)-2,3-dihydro-1H-inden-1-ol
CID 95012649
2-[[(5S)-5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]-N-(4-propan-2-ylphenyl)acetamide
CID 39921821
2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-1-piperidin-1-ylethanone
CID 63090854

Frequently Asked Questions

What is the IUPAC name of 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide?
The IUPAC name of 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide (CID 63090874) is 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide?
The canonical SMILES for 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide is CC(C)NC(=O)CCOc1cccc2c1CCC2O.
What is the InChIKey of 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide?
The InChIKey is SLYNZIQBUGUNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-10(2)16-15(18)8-9-19-14-5-3-4-11-12(14)6-7-13(11)17/h3-5,10,13,17H,6-9H2,1-2H3,(H,16,18).
What are the key properties of 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide?
3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide has a molecular weight of 263.34 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide is sourced from PubChem (CID 63090874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).