2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone

C10H9FN2O — CID 82402932

IUPAC2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone
SMILESNCC(=O)c1cc2c(F)cccc2[nH]1
InChIInChI=1S/C10H9FN2O/c11-7-2-1-3-8-6(7)4-9(13-8)10(14)5-12/h1-4,13H,5,12H2
InChIKeyHCOYEQWYLSIQBD-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.45
Rot. Bonds2

About 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone

2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone (PubChem CID 82402932) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone
PubChem CID82402932
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone
SMILESNCC(=O)c1cc2c(F)cccc2[nH]1
InChIInChI=1S/C10H9FN2O/c11-7-2-1-3-8-6(7)4-9(13-8)10(14)5-12/h1-4,13H,5,12H2
InChIKeyHCOYEQWYLSIQBD-UHFFFAOYSA-N
XLogP1.45
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(4-methyl-1H-indol-2-yl)ethanone
CID 82405076
N-[4-(carbamoylamino)phenyl]-4-fluoro-1H-indole-2-carboxamide
CID 36852655
methyl 2-[(4-fluoro-1H-indole-2-carbonyl)amino]acetate
CID 47153631
N-[2-(2,6-difluorophenyl)-2-hydroxyethyl]-4-fluoro-1H-indole-2-carboxamide
CID 111451520
4-fluoro-N-(1-hydroxypropan-2-yl)-N-methyl-1H-indole-2-carboxamide
CID 109388525
3-[(4-fluoro-1H-indole-2-carbonyl)-methylamino]-2-methylpropanoic acid
CID 119228216
methyl (3S)-3-[(4-fluoro-1H-indole-2-carbonyl)amino]butanoate
CID 95933772
N-cyclopropyl-4-fluoro-N-[(2-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 36746307
N-[(5-bromo-2-fluorophenyl)methyl]-4-fluoro-N-methyl-1H-indole-2-carboxamide
CID 55580692
4-fluoro-N-(4-hydroxycyclohexyl)-1H-indole-2-carboxamide
CID 134010426
(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone
CID 47151027
N-[(1E)-1-chlorobuta-1,3-dienyl]-4-fluoro-1H-indole-2-carboxamide
CID 138645375

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone?
The IUPAC name of 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone (CID 82402932) is 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone.
What is the SMILES notation for 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone?
The canonical SMILES for 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone is NCC(=O)c1cc2c(F)cccc2[nH]1.
What is the InChIKey of 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone?
The InChIKey is HCOYEQWYLSIQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c11-7-2-1-3-8-6(7)4-9(13-8)10(14)5-12/h1-4,13H,5,12H2.
What are the key properties of 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone?
2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone has a molecular weight of 192.19 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-fluoro-1H-indol-2-yl)ethanone is sourced from PubChem (CID 82402932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).