(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine

C9H11FN2 — CID 55275275

IUPAC(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine
SMILESNc1cc(F)c2c(c1)[C@H](N)CC2
InChIInChI=1S/C9H11FN2/c10-8-4-5(11)3-7-6(8)1-2-9(7)12/h3-4,9H,1-2,11-12H2/t9-/m1/s1
InChIKeyQVYGIDSSOZGDND-SECBINFHSA-N
MW166.20 g/mol
LogP1.35
Rot. Bonds

About (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine

(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine (PubChem CID 55275275) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine.

Molecular Properties

Compound Name(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine
PubChem CID55275275
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine
SMILESNc1cc(F)c2c(c1)[C@H](N)CC2
InChIInChI=1S/C9H11FN2/c10-8-4-5(11)3-7-6(8)1-2-9(7)12/h3-4,9H,1-2,11-12H2/t9-/m1/s1
InChIKeyQVYGIDSSOZGDND-SECBINFHSA-N
XLogP1.35
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine?
The IUPAC name of (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine (CID 55275275) is (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine.
What is the SMILES notation for (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine?
The canonical SMILES for (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine is Nc1cc(F)c2c(c1)[C@H](N)CC2.
What is the InChIKey of (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine?
The InChIKey is QVYGIDSSOZGDND-SECBINFHSA-N. The full InChI is InChI=1S/C9H11FN2/c10-8-4-5(11)3-7-6(8)1-2-9(7)12/h3-4,9H,1-2,11-12H2/t9-/m1/s1.
What are the key properties of (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine?
(1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine has a molecular weight of 166.20 g/mol, XLogP of 1.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-4-fluoro-2,3-dihydro-1H-indene-1,6-diamine is sourced from PubChem (CID 55275275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).