N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide

C12H16N2O2 — CID 166991162

IUPACN-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1Cc2ccccc2[C@H]1N
InChIInChI=1S/C12H16N2O2/c1-16-7-11(15)14-10-6-8-4-2-3-5-9(8)12(10)13/h2-5,10,12H,6-7,13H2,1H3,(H,14,15)/t10?,12-/m1/s1
InChIKeyUPHBTONZOOYAAD-TVKKRMFBSA-N
MW220.27 g/mol
LogP0.37
Rot. Bonds3

About N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide

N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide (PubChem CID 166991162) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
PubChem CID166991162
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1Cc2ccccc2[C@H]1N
InChIInChI=1S/C12H16N2O2/c1-16-7-11(15)14-10-6-8-4-2-3-5-9(8)12(10)13/h2-5,10,12H,6-7,13H2,1H3,(H,14,15)/t10?,12-/m1/s1
InChIKeyUPHBTONZOOYAAD-TVKKRMFBSA-N
XLogP0.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]propanamide
CID 165456832
N-[(1S,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxyacetamide
CID 139796474
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxyacetamide
CID 101173546
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide
CID 138049844
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-methoxyacetamide
CID 24895519
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-[4-(trifluoromethyl)-3-pyridinyl]acetamide
CID 138011362
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-3-(1-methylpyrazol-4-yl)propanamide;hydrochloride
CID 154901298
N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
CID 144626033
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]pyridine-4-carboxamide
CID 142582886
N-[2-(2-chlorophenyl)cyclopropyl]-2-methoxyacetamide
CID 90019460
N-[(1S,2R)-2-(2-chlorophenyl)cyclopropyl]-2-methoxyacetamide
CID 90020152
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(benzotriazol-1-yl)acetamide;dihydrochloride
CID 154577752

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide?
The IUPAC name of N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide (CID 166991162) is N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide is COCC(=O)NC1Cc2ccccc2[C@H]1N.
What is the InChIKey of N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide?
The InChIKey is UPHBTONZOOYAAD-TVKKRMFBSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-16-7-11(15)14-10-6-8-4-2-3-5-9(8)12(10)13/h2-5,10,12H,6-7,13H2,1H3,(H,14,15)/t10?,12-/m1/s1.
What are the key properties of N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide?
N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide has a molecular weight of 220.27 g/mol, XLogP of 0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide is sourced from PubChem (CID 166991162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).