(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine

C11H14FNO — CID 130845713

IUPAC(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
SMILESC[C@@H](N)c1c(F)ccc2c1OCCC2
InChIInChI=1S/C11H14FNO/c1-7(13)10-9(12)5-4-8-3-2-6-14-11(8)10/h4-5,7H,2-3,6,13H2,1H3/t7-/m1/s1
InChIKeyLSPJQOWSQBZJQQ-SSDOTTSWSA-N
MW195.24 g/mol
LogP2.17
Rot. Bonds1

About (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine

(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine (PubChem CID 130845713) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
PubChem CID130845713
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
SMILESC[C@@H](N)c1c(F)ccc2c1OCCC2
InChIInChI=1S/C11H14FNO/c1-7(13)10-9(12)5-4-8-3-2-6-14-11(8)10/h4-5,7H,2-3,6,13H2,1H3/t7-/m1/s1
InChIKeyLSPJQOWSQBZJQQ-SSDOTTSWSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
CID 117301278
8-bromo-7-fluoro-3,4-dihydro-2H-chromene
CID 155778553
7-fluoro-3,4-dihydro-2H-chromen-8-ol
CID 10630931
1-(2,3,4,7,8,9-hexahydropyrano[2,3-g]chromen-5-yl)ethanamine
CID 115010138
7-propan-2-yl-3,4-dihydro-2H-chromen-8-amine
CID 160922016
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
CID 117413291
7-fluoro-3,4-dihydro-2H-chromene-8-carboxylic acid
CID 22404817
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclopropyl]methanamine
CID 117315960
1-[2-(3,4-dihydro-2H-chromen-8-yl)phenyl]ethanamine
CID 114746628
(2,5-difluorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanamine
CID 114745341
4-amino-4-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)butanoic acid
CID 117350314
8-fluoro-3,4-dihydro-2H-chromen-7-ol
CID 101361843

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine?
The IUPAC name of (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine (CID 130845713) is (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine.
What is the SMILES notation for (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine?
The canonical SMILES for (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine is C[C@@H](N)c1c(F)ccc2c1OCCC2.
What is the InChIKey of (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine?
The InChIKey is LSPJQOWSQBZJQQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H14FNO/c1-7(13)10-9(12)5-4-8-3-2-6-14-11(8)10/h4-5,7H,2-3,6,13H2,1H3/t7-/m1/s1.
What are the key properties of (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine?
(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine has a molecular weight of 195.24 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine is sourced from PubChem (CID 130845713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).