(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol

C9H10FNO — CID 130639484

IUPAC(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol
SMILESN[C@H]1CCc2c(O)cc(F)cc21
InChIInChI=1S/C9H10FNO/c10-5-3-7-6(9(12)4-5)1-2-8(7)11/h3-4,8,12H,1-2,11H2/t8-/m0/s1
InChIKeyQYXNCPXWIHKXKB-QMMMGPOBSA-N
MW167.18 g/mol
LogP1.48
Rot. Bonds

About (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol

(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol (PubChem CID 130639484) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol
PubChem CID130639484
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol
SMILESN[C@H]1CCc2c(O)cc(F)cc21
InChIInChI=1S/C9H10FNO/c10-5-3-7-6(9(12)4-5)1-2-8(7)11/h3-4,8,12H,1-2,11H2/t8-/m0/s1
InChIKeyQYXNCPXWIHKXKB-QMMMGPOBSA-N
XLogP1.48
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 167722097
(1S)-1-amino-6-fluoro-2,3-dihydro-1H-indene-4-carboxylic acid
CID 131095589
(1S)-1-amino-6-methoxy-2,3-dihydro-1H-inden-4-ol
CID 130664492
1-amino-4,6-difluoro-2,3-dihydro-1H-inden-5-ol
CID 55270940
(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine
CID 55275275
(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-4-carbonitrile
CID 130691990
(3S)-3-amino-7-iodo-2,3-dihydro-1H-inden-5-ol
CID 130648423
(1R)-6-bromo-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 66799240
(1S)-7-fluoro-5-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 131365388
(1R)-4-fluoro-5-methyl-2,3-dihydro-1H-indene-1,6-diamine
CID 55274698
(1R)-1-amino-5,7-difluoro-2,3-dihydro-1H-inden-4-ol
CID 55274996
(1S)-4,5-difluoro-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55272365

Frequently Asked Questions

What is the IUPAC name of (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol (CID 130639484) is (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol is N[C@H]1CCc2c(O)cc(F)cc21.
What is the InChIKey of (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol?
The InChIKey is QYXNCPXWIHKXKB-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H10FNO/c10-5-3-7-6(9(12)4-5)1-2-8(7)11/h3-4,8,12H,1-2,11H2/t8-/m0/s1.
What are the key properties of (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol?
(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol has a molecular weight of 167.18 g/mol, XLogP of 1.48, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 130639484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).