(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride

C10H11ClFNO2 — CID 66798942

IUPAC(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride
SMILESCl.N[C@@H]1CCc2cc(C(=O)O)c(F)cc21
InChIInChI=1S/C10H10FNO2.ClH/c11-8-4-6-5(1-2-9(6)12)3-7(8)10(13)14;/h3-4,9H,1-2,12H2,(H,13,14);1H/t9-;/m1./s1
InChIKeyUTXGQQGDUZPGLC-SBSPUUFOSA-N
MW231.65 g/mol
LogP1.89
Rot. Bonds1

About (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride

(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride (PubChem CID 66798942) has the molecular formula C10H11ClFNO2 and a molecular weight of 231.65 g/mol. Its IUPAC name is (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride
PubChem CID66798942
Molecular FormulaC10H11ClFNO2
Molecular Weight231.65 g/mol
Exact Mass231.05
IUPAC Name(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride
SMILESCl.N[C@@H]1CCc2cc(C(=O)O)c(F)cc21
InChIInChI=1S/C10H10FNO2.ClH/c11-8-4-6-5(1-2-9(6)12)3-7(8)10(13)14;/h3-4,9H,1-2,12H2,(H,13,14);1H/t9-;/m1./s1
InChIKeyUTXGQQGDUZPGLC-SBSPUUFOSA-N
XLogP1.89
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.65
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride?
The IUPAC name of (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride (CID 66798942) is (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride.
What is the SMILES notation for (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride?
The canonical SMILES for (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride is Cl.N[C@@H]1CCc2cc(C(=O)O)c(F)cc21.
What is the InChIKey of (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride?
The InChIKey is UTXGQQGDUZPGLC-SBSPUUFOSA-N. The full InChI is InChI=1S/C10H10FNO2.ClH/c11-8-4-6-5(1-2-9(6)12)3-7(8)10(13)14;/h3-4,9H,1-2,12H2,(H,13,14);1H/t9-;/m1./s1.
What are the key properties of (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride?
(1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride has a molecular weight of 231.65 g/mol, XLogP of 1.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-amino-6-fluoro-2,3-dihydro-1H-indene-5-carboxylic acid;hydrochloride is sourced from PubChem (CID 66798942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).