(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

C19H22FN — CID 106881515

IUPAC(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCc1cc(C)c(C(N)C2CCCc3ccccc32)c(F)c1
InChIInChI=1S/C19H22FN/c1-12-10-13(2)18(17(20)11-12)19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-4,6,8,10-11,16,19H,5,7,9,21H2,1-2H3
InChIKeyJUPCIGAWLRYABX-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.56
Rot. Bonds2

About (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (PubChem CID 106881515) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.

Molecular Properties

Compound Name(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
PubChem CID106881515
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC Name(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCc1cc(C)c(C(N)C2CCCc3ccccc32)c(F)c1
InChIInChI=1S/C19H22FN/c1-12-10-13(2)18(17(20)11-12)19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-4,6,8,10-11,16,19H,5,7,9,21H2,1-2H3
InChIKeyJUPCIGAWLRYABX-UHFFFAOYSA-N
XLogP4.56
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-fluoro-4,6-dimethylphenyl)-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methanamine
CID 106883693
(3-fluorophenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63247325
(2-chloro-4,5-difluorophenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 107476058
(5-fluoro-2-methoxyphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 62718085
7-bicyclo[4.2.0]octa-1,3,5-trienyl-(2,6-difluoro-3-methylphenyl)methanamine
CID 82822545
[(3,5-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218933
2,3-dihydro-1H-inden-1-yl-(4-fluoro-2-methylphenyl)methanamine
CID 65406101
[(5-fluoro-2-methylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218802
2-(3-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 63247283
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
(3,4-difluorophenyl)-(2,3-dihydro-1H-inden-1-yl)methanamine
CID 65405327
(4-bromo-3-chloro-2-fluorophenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 106762496

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (CID 106881515) is (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.
What is the SMILES notation for (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The canonical SMILES for (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is Cc1cc(C)c(C(N)C2CCCc3ccccc32)c(F)c1.
What is the InChIKey of (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The InChIKey is JUPCIGAWLRYABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-12-10-13(2)18(17(20)11-12)19(21)16-9-5-7-14-6-3-4-8-15(14)16/h3-4,6,8,10-11,16,19H,5,7,9,21H2,1-2H3.
What are the key properties of (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine has a molecular weight of 283.39 g/mol, XLogP of 4.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is sourced from PubChem (CID 106881515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).