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

C19H22FN — CID 105053588

IUPAC1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cccc(C2CCC2)c1)c1ccc(C)cc1F
InChIInChI=1S/C19H22FN/c1-13-9-10-17(18(20)11-13)19(21-2)16-8-4-7-15(12-16)14-5-3-6-14/h4,7-12,14,19,21H,3,5-6H2,1-2H3
InChIKeyHUOMSQNAHLYVMT-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.71
Rot. Bonds4

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

1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine (PubChem CID 105053588) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine
PubChem CID105053588
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC Name1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cccc(C2CCC2)c1)c1ccc(C)cc1F
InChIInChI=1S/C19H22FN/c1-13-9-10-17(18(20)11-13)19(21-2)16-8-4-7-15(12-16)14-5-3-6-14/h4,7-12,14,19,21H,3,5-6H2,1-2H3
InChIKeyHUOMSQNAHLYVMT-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

1-(2-fluoro-4-methylphenyl)-1-(3-fluorophenyl)-N-methylmethanamine
CID 115791781
1-(3-cyclobutylphenyl)-1-(2-iodophenyl)-N-methylmethanamine
CID 105053633
1-(2-chlorofuran-3-yl)-1-(3-cyclobutylphenyl)-N-methylmethanamine
CID 106693358
1-(4-cyclobutylphenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 116506091
1-(4-chloro-3-methylphenyl)-1-(3-cyclobutylphenyl)-N-methylmethanamine
CID 105053787
1-(2-fluoro-4-methylphenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]methanamine
CID 105050619
(3-cyclobutylphenyl)-(2,4-dimethylphenyl)methanol
CID 114601241
1-(2-fluoro-4-methylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 107130367
1-(2-fluoro-4-methylphenyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 115850961
N-[(3-cyclobutylphenyl)-(4-methylphenyl)methyl]ethanamine
CID 114602617
1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 105044965
[(3-cyclobutylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105342013

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine (CID 105053588) is 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine is CNC(c1cccc(C2CCC2)c1)c1ccc(C)cc1F.
What is the InChIKey of 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine?
The InChIKey is HUOMSQNAHLYVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-13-9-10-17(18(20)11-13)19(21-2)16-8-4-7-15(12-16)14-5-3-6-14/h4,7-12,14,19,21H,3,5-6H2,1-2H3.
What are the key properties of 1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine?
1-(3-cyclobutylphenyl)-1-(2-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-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 105053588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).