(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine

C12H16FN — CID 83907573

IUPAC(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine
SMILESCC1(C)Cc2ccc(F)cc2C1CN
InChIInChI=1S/C12H16FN/c1-12(2)6-8-3-4-9(13)5-10(8)11(12)7-14/h3-5,11H,6-7,14H2,1-2H3
InChIKeySCEZNPIYTLTMCG-UHFFFAOYSA-N
MW193.26 g/mol
LogP2.45
Rot. Bonds1

About (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine

(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine (PubChem CID 83907573) has the molecular formula C12H16FN and a molecular weight of 193.26 g/mol. Its IUPAC name is (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine.

Molecular Properties

Compound Name(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine
PubChem CID83907573
Molecular FormulaC12H16FN
Molecular Weight193.26 g/mol
Exact Mass193.13
IUPAC Name(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine
SMILESCC1(C)Cc2ccc(F)cc2C1CN
InChIInChI=1S/C12H16FN/c1-12(2)6-8-3-4-9(13)5-10(8)11(12)7-14/h3-5,11H,6-7,14H2,1-2H3
InChIKeySCEZNPIYTLTMCG-UHFFFAOYSA-N
XLogP2.45
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.26
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(7S)-4-fluoro-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methanamine
CID 98041428
2,2,6-trifluoro-1-prop-2-enyl-1,3-dihydroindene
CID 163265513
(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
(7-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 83907571
4,13-difluoro-9-methyl-17-azatetracyclo[7.6.2.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene
CID 24966129
6-chloro-N-[(4-fluorophenyl)methyl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 83067455
2-(6-fluoro-2-methyl-2,3-dihydro-1H-inden-1-yl)propan-1-amine
CID 112716066
(3,3,7-trimethyl-2,4-dihydro-1H-naphthalen-1-yl)methanamine
CID 84620108
(6-fluoro-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84718266
(6-bromo-4',4'-difluorospiro[1,3-dihydroindene-2,1'-cyclohexane]-1-yl)methanamine
CID 123340415
(5-fluoro-2,3-dihydro-1-benzofuran-3-yl)methanamine
CID 55263545
(2-cyclopropyl-6-fluoro-1,3-dihydroisoindol-1-yl)methanamine
CID 82545575

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine?
The IUPAC name of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine (CID 83907573) is (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine.
What is the SMILES notation for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine?
The canonical SMILES for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine is CC1(C)Cc2ccc(F)cc2C1CN.
What is the InChIKey of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine?
The InChIKey is SCEZNPIYTLTMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-12(2)6-8-3-4-9(13)5-10(8)11(12)7-14/h3-5,11H,6-7,14H2,1-2H3.
What are the key properties of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine?
(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine has a molecular weight of 193.26 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)methanamine is sourced from PubChem (CID 83907573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).