2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol

C11H14FNO — CID 83070069

IUPAC2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol
SMILESNC1(CCO)CCc2c(F)cccc21
InChIInChI=1S/C11H14FNO/c12-10-3-1-2-9-8(10)4-5-11(9,13)6-7-14/h1-3,14H,4-7,13H2
InChIKeyZRVVOVYGSNHKMV-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.31
Rot. Bonds2

About 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol

2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol (PubChem CID 83070069) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol.

Molecular Properties

Compound Name2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol
PubChem CID83070069
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol
SMILESNC1(CCO)CCc2c(F)cccc21
InChIInChI=1S/C11H14FNO/c12-10-3-1-2-9-8(10)4-5-11(9,13)6-7-14/h1-3,14H,4-7,13H2
InChIKeyZRVVOVYGSNHKMV-UHFFFAOYSA-N
XLogP1.31
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(ethylamino)-4-fluoro-2,3-dihydroinden-1-yl]ethanol
CID 83070068
(1R)-1-amino-4-fluoro-2,3-dihydroindene-1-carboxylic acid
CID 97055121
(1-amino-4-chloro-2,3-dihydroinden-1-yl)methanol
CID 83908135
(1-amino-5-fluoro-2-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 112716328
2-(4-fluoro-1-hydroxy-2,3-dihydroinden-1-yl)acetaldehyde
CID 114795365
2-(4-fluoro-1-hydroxy-2,3-dihydroinden-1-yl)acetonitrile
CID 83069835
1-(2,3-dihydro-1H-inden-5-ylmethyl)-4-fluoro-2,3-dihydroinden-1-ol
CID 83057965
1-(ethylaminomethyl)-4-fluoro-2,3-dihydroinden-1-ol
CID 83070139
4,4,8-trifluoro-2,3-dihydro-1H-naphthalene
CID 84718996
1-(3-ethylsulfonylpropyl)-4-fluoro-2,3-dihydroinden-1-ol
CID 83069176
[4-fluoro-1-(3-methoxyanilino)-2,3-dihydroinden-1-yl]methanol
CID 83058682
1-[(3,4-difluorophenyl)methyl]-4-fluoro-2,3-dihydroinden-1-ol
CID 83069495

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol?
The IUPAC name of 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol (CID 83070069) is 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol.
What is the SMILES notation for 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol?
The canonical SMILES for 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol is NC1(CCO)CCc2c(F)cccc21.
What is the InChIKey of 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol?
The InChIKey is ZRVVOVYGSNHKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-10-3-1-2-9-8(10)4-5-11(9,13)6-7-14/h1-3,14H,4-7,13H2.
What are the key properties of 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol?
2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol has a molecular weight of 195.24 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-4-fluoro-2,3-dihydroinden-1-yl)ethanol is sourced from PubChem (CID 83070069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).