1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine

C12H14FN — CID 105445138

IUPAC1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine
SMILESCC(N)C1=Cc2cc(F)ccc2CC1
InChIInChI=1S/C12H14FN/c1-8(14)10-3-2-9-4-5-12(13)7-11(9)6-10/h4-8H,2-3,14H2,1H3
InChIKeyJPVPPBFRVQIROO-UHFFFAOYSA-N
MW191.25 g/mol
LogP2.50
Rot. Bonds1

About 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine

1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine (PubChem CID 105445138) has the molecular formula C12H14FN and a molecular weight of 191.25 g/mol. Its IUPAC name is 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine
PubChem CID105445138
Molecular FormulaC12H14FN
Molecular Weight191.25 g/mol
Exact Mass191.11
IUPAC Name1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine
SMILESCC(N)C1=Cc2cc(F)ccc2CC1
InChIInChI=1S/C12H14FN/c1-8(14)10-3-2-9-4-5-12(13)7-11(9)6-10/h4-8H,2-3,14H2,1H3
InChIKeyJPVPPBFRVQIROO-UHFFFAOYSA-N
XLogP2.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methyl 2-(6-fluoro-3,4-dihydronaphthalen-2-yl)propanoate
CID 70590431
2-(5-fluoro-1H-inden-2-yl)-3-methylbutanoic acid
CID 23347075
1-[5-(trifluoromethoxy)-1H-inden-2-yl]ethanamine
CID 158170863
3-(4-ethylcyclohexyl)-6-fluoro-1,2-dihydronaphthalene
CID 139961417
1-(2-chloro-4-fluorophenyl)ethanamine
CID 18542888
1-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)ethanamine
CID 146221659
(1R)-1-[4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496814
(1S)-1-[3-chloro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496697
(1R)-1-[3-chloro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496695
1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine
CID 117283964
N-[1-amino-3-(7-fluoro-3,4-dihydronaphthalen-2-yl)-1-oxopropan-2-yl]-N-[(1R)-1-phenylethyl]benzamide
CID 54161620
(1S)-1-(2,5-difluorophenyl)ethanamine;hydrochloride
CID 53484729

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine?
The IUPAC name of 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine (CID 105445138) is 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine is CC(N)C1=Cc2cc(F)ccc2CC1.
What is the InChIKey of 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine?
The InChIKey is JPVPPBFRVQIROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN/c1-8(14)10-3-2-9-4-5-12(13)7-11(9)6-10/h4-8H,2-3,14H2,1H3.
What are the key properties of 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine?
1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine has a molecular weight of 191.25 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-3,4-dihydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 105445138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).