1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine

C19H22FN — CID 114602710

IUPAC1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(C)c(F)c1)c1ccccc1C1CCC1
InChIInChI=1S/C19H22FN/c1-13-10-11-15(12-18(13)20)19(21-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,19,21H,5-7H2,1-2H3
InChIKeyIOFYAKXYTPQPPE-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.71
Rot. Bonds4

About 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine

1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine (PubChem CID 114602710) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
PubChem CID114602710
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC Name1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(C)c(F)c1)c1ccccc1C1CCC1
InChIInChI=1S/C19H22FN/c1-13-10-11-15(12-18(13)20)19(21-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,19,21H,5-7H2,1-2H3
InChIKeyIOFYAKXYTPQPPE-UHFFFAOYSA-N
XLogP4.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-cyclobutylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 114601272
1-(4-bromophenyl)-1-(2-cyclobutylphenyl)-N-methylmethanamine
CID 114602530
1-(2-cyclobutylphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 105188892
1-(2-cyclobutylphenyl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 105052188
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
CID 114604437
[(2-cyclobutylphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105341325
1-(3-chloro-2-fluorophenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 107128750
1-(3-fluoro-4-methylphenyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102831967
1-(3-cyclopropyloxyphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 114521568
[(2-cyclobutylphenyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105256613
1-(5-chloro-2-methylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 107130085
1-(3-fluoro-4-methylphenyl)-N-methyl-1-(2,3,4-trifluorophenyl)methanamine
CID 62963780

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine (CID 114602710) is 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine is CNC(c1ccc(C)c(F)c1)c1ccccc1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine?
The InChIKey is IOFYAKXYTPQPPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-13-10-11-15(12-18(13)20)19(21-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,19,21H,5-7H2,1-2H3.
What are the key properties of 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine?
1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine has a molecular weight of 283.39 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 114602710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).