2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine

C13H18FN — CID 112716066

IUPAC2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine
SMILESCC(CN)C1c2cc(F)ccc2CC1C
InChIInChI=1S/C13H18FN/c1-8-5-10-3-4-11(14)6-12(10)13(8)9(2)7-15/h3-4,6,8-9,13H,5,7,15H2,1-2H3
InChIKeyORHYZETUAKIAPP-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.70
Rot. Bonds2

About 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine

2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine (PubChem CID 112716066) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine.

Molecular Properties

Compound Name2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine
PubChem CID112716066
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine
SMILESCC(CN)C1c2cc(F)ccc2CC1C
InChIInChI=1S/C13H18FN/c1-8-5-10-3-4-11(14)6-12(10)13(8)9(2)7-15/h3-4,6,8-9,13H,5,7,15H2,1-2H3
InChIKeyORHYZETUAKIAPP-UHFFFAOYSA-N
XLogP2.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine?
The IUPAC name of 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine (CID 112716066) is 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine.
What is the SMILES notation for 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine?
The canonical SMILES for 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine is CC(CN)C1c2cc(F)ccc2CC1C.
What is the InChIKey of 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine?
The InChIKey is ORHYZETUAKIAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-8-5-10-3-4-11(14)6-12(10)13(8)9(2)7-15/h3-4,6,8-9,13H,5,7,15H2,1-2H3.
What are the key properties of 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine?
2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine has a molecular weight of 207.29 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine is sourced from PubChem (CID 112716066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).