1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

C20H25N — CID 105044965

IUPAC1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(C2CCC2)cc1)c1cc(C)ccc1C
InChIInChI=1S/C20H25N/c1-14-7-8-15(2)19(13-14)20(21-3)18-11-9-17(10-12-18)16-5-4-6-16/h7-13,16,20-21H,4-6H2,1-3H3
InChIKeyPDYYNNBJINNYEY-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.88
Rot. Bonds4

About 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (PubChem CID 105044965) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
PubChem CID105044965
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC Name1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(C2CCC2)cc1)c1cc(C)ccc1C
InChIInChI=1S/C20H25N/c1-14-7-8-15(2)19(13-14)20(21-3)18-11-9-17(10-12-18)16-5-4-6-16/h7-13,16,20-21H,4-6H2,1-3H3
InChIKeyPDYYNNBJINNYEY-UHFFFAOYSA-N
XLogP4.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-cyclobutylphenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 116506091
1-(4-cyclobutylphenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 116506024
1-(4-cyclobutylphenyl)-1-(3,5-dichlorophenyl)-N-methylmethanamine
CID 105045036
1-(4-cyclobutylphenyl)-1-(2-ethylphenyl)-N-methylmethanamine
CID 105045096
1-(4-cyclobutylphenyl)-N-methyl-1-(2,4,5-trimethylfuran-3-yl)methanamine
CID 105044978
1-(3-cyclobutylphenyl)-1-(2-fluoro-4-methylphenyl)-N-methylmethanamine
CID 105053588
1-(3,4-diethylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 115482248
1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine
CID 116954314
1-(4-bromo-3-fluorophenyl)-1-(4-cyclobutylphenyl)-N-methylmethanamine
CID 105044859
1-(4-cyclohexylphenyl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 43484975
1-(2,5-dimethylphenyl)-1-(3-iodophenyl)-N-methylmethanamine
CID 43483766
1-(4-chloro-3-methylphenyl)-1-(3-cyclobutylphenyl)-N-methylmethanamine
CID 105053787

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (CID 105044965) is 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is CNC(c1ccc(C2CCC2)cc1)c1cc(C)ccc1C.
What is the InChIKey of 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The InChIKey is PDYYNNBJINNYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-14-7-8-15(2)19(13-14)20(21-3)18-11-9-17(10-12-18)16-5-4-6-16/h7-13,16,20-21H,4-6H2,1-3H3.
What are the key properties of 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine has a molecular weight of 279.43 g/mol, XLogP of 4.88, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclobutylphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 105044965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).