2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide

C12H15FN2O — CID 154740189

IUPAC2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide
SMILESCN(CC(N)=O)C1CCc2ccc(F)cc21
InChIInChI=1S/C12H15FN2O/c1-15(7-12(14)16)11-5-3-8-2-4-9(13)6-10(8)11/h2,4,6,11H,3,5,7H2,1H3,(H2,14,16)
InChIKeyGTAUIVQJOAPRCJ-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.23
Rot. Bonds3

About 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide

2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide (PubChem CID 154740189) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide.

Molecular Properties

Compound Name2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide
PubChem CID154740189
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide
SMILESCN(CC(N)=O)C1CCc2ccc(F)cc21
InChIInChI=1S/C12H15FN2O/c1-15(7-12(14)16)11-5-3-8-2-4-9(13)6-10(8)11/h2,4,6,11H,3,5,7H2,1H3,(H2,14,16)
InChIKeyGTAUIVQJOAPRCJ-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
4-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]butanoic acid
CID 116532347
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 134043061
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]benzamide
CID 118935130
(7-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 83907571
3-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]-1-methyl-1-prop-2-enylurea
CID 99856542
3-[(1S)-6-fluoro-2,3-dihydro-1H-inden-1-yl]-1-methyl-1-prop-2-enylurea
CID 99856543
7-fluoro-2-hydroxy-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
CID 115026714
3-[[benzoyl-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]amino]methyl]pyridine-2-carboxamide
CID 118935697
N-[(1R)-5-fluoro-2,3-dihydro-1H-inden-1-yl]-N-methylbenzamide
CID 144743792
2-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylacetamide
CID 82080013
3-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)-methylamino]-2-methylpropanoic acid
CID 79368771

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide?
The IUPAC name of 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide (CID 154740189) is 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide.
What is the SMILES notation for 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide?
The canonical SMILES for 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide is CN(CC(N)=O)C1CCc2ccc(F)cc21.
What is the InChIKey of 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide?
The InChIKey is GTAUIVQJOAPRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c1-15(7-12(14)16)11-5-3-8-2-4-9(13)6-10(8)11/h2,4,6,11H,3,5,7H2,1H3,(H2,14,16).
What are the key properties of 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide?
2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide has a molecular weight of 222.26 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide is sourced from PubChem (CID 154740189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).