6-fluoro-N-methoxy-3H-inden-1-amine

C10H10FNO — CID 91246729

IUPAC6-fluoro-N-methoxy-3H-inden-1-amine
SMILESCONC1=CCc2ccc(F)cc21
InChIInChI=1S/C10H10FNO/c1-13-12-10-5-3-7-2-4-8(11)6-9(7)10/h2,4-6,12H,3H2,1H3
InChIKeyXONVUCGXWPLXFX-UHFFFAOYSA-N
MW179.19 g/mol
LogP1.87
Rot. Bonds2

About 6-fluoro-N-methoxy-3H-inden-1-amine

6-fluoro-N-methoxy-3H-inden-1-amine (PubChem CID 91246729) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 6-fluoro-N-methoxy-3H-inden-1-amine.

Molecular Properties

Compound Name6-fluoro-N-methoxy-3H-inden-1-amine
PubChem CID91246729
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name6-fluoro-N-methoxy-3H-inden-1-amine
SMILESCONC1=CCc2ccc(F)cc21
InChIInChI=1S/C10H10FNO/c1-13-12-10-5-3-7-2-4-8(11)6-9(7)10/h2,4-6,12H,3H2,1H3
InChIKeyXONVUCGXWPLXFX-UHFFFAOYSA-N
XLogP1.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

n-(4-Fluoro-2-trifluoromethyl-benzyl)-o-methyl-hydroxylamine
CID 23499553
Inden-3-amine
CID 21343725
n-[1-(4-Fluoro-phenyl)-ethyl]-o-methyl-hydroxylamine
CID 22485632
N-[1-(2-fluoro-5-methylphenyl)ethenyl]hydroxylamine
CID 23394254
6-fluoro-N-methyl-3H-inden-1-amine
CID 54311471
1-[2-fluoro-4-(trifluoromethyl)phenyl]-N-methoxyethenamine
CID 56974312
N-methoxy-1-[3-(trifluoromethyl)phenyl]ethenamine
CID 56978932
2-(4-fluorophenyl)-N-methoxy-1-phenylethenamine
CID 56985679
3,3,3-trifluoro-1-(4-fluorophenyl)-N-methoxyprop-1-en-1-amine
CID 57025597
1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-methoxyethenamine
CID 57046147
1-(2,4-difluorophenyl)-N-methoxyethenamine
CID 57050334
1-(3,4-difluorophenyl)-N-methoxyethenamine
CID 57058181

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methoxy-3H-inden-1-amine?
The IUPAC name of 6-fluoro-N-methoxy-3H-inden-1-amine (CID 91246729) is 6-fluoro-N-methoxy-3H-inden-1-amine.
What is the SMILES notation for 6-fluoro-N-methoxy-3H-inden-1-amine?
The canonical SMILES for 6-fluoro-N-methoxy-3H-inden-1-amine is CONC1=CCc2ccc(F)cc21.
What is the InChIKey of 6-fluoro-N-methoxy-3H-inden-1-amine?
The InChIKey is XONVUCGXWPLXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c1-13-12-10-5-3-7-2-4-8(11)6-9(7)10/h2,4-6,12H,3H2,1H3.
What are the key properties of 6-fluoro-N-methoxy-3H-inden-1-amine?
6-fluoro-N-methoxy-3H-inden-1-amine has a molecular weight of 179.19 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methoxy-3H-inden-1-amine is sourced from PubChem (CID 91246729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).