1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine

C15H23N — CID 43484275

IUPAC1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
SMILESCNC(c1c(C)cc(C)cc1C)C1CCC1
InChIInChI=1S/C15H23N/c1-10-8-11(2)14(12(3)9-10)15(16-4)13-6-5-7-13/h8-9,13,15-16H,5-7H2,1-4H3
InChIKeyCZBQGLFZTTUHJC-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.67
Rot. Bonds3

About 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine

1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine (PubChem CID 43484275) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
PubChem CID43484275
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
SMILESCNC(c1c(C)cc(C)cc1C)C1CCC1
InChIInChI=1S/C15H23N/c1-10-8-11(2)14(12(3)9-10)15(16-4)13-6-5-7-13/h8-9,13,15-16H,5-7H2,1-4H3
InChIKeyCZBQGLFZTTUHJC-UHFFFAOYSA-N
XLogP3.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[methylamino-(2,4,6-trimethylphenyl)methyl]cyclohexan-1-ol
CID 116957010
1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
CID 106680447
1-cyclopropyl-1-(4-fluoro-2,6-dimethylphenyl)-N-methylmethanamine
CID 106877639
1-cyclobutyl-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79705578
N-methyl-1-(5-methyloxolan-3-yl)-1-(2,4,6-trimethylphenyl)methanamine
CID 114825011
N-[cycloheptyl-(2,4,6-trimethylphenyl)methyl]propan-1-amine
CID 63503195
N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)-1-(2,4,6-trimethylphenyl)methanamine
CID 66478016
1-(1,1-dioxothian-2-yl)-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 104518499
1-(2-chloro-4-fluoro-5-methylphenyl)-1-cyclobutyl-N-methylmethanamine
CID 81045832
[cyclopentyl-(2-methoxy-4,6-dimethylphenyl)methyl]hydrazine
CID 106682698
cycloheptyl-(2,4,6-trimethylphenyl)methanamine
CID 63522004
(R)-cyclohexyl-(2,4,6-trimethylphenyl)methanamine
CID 92649968

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine?
The IUPAC name of 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine (CID 43484275) is 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine.
What is the SMILES notation for 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine?
The canonical SMILES for 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine is CNC(c1c(C)cc(C)cc1C)C1CCC1.
What is the InChIKey of 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine?
The InChIKey is CZBQGLFZTTUHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-10-8-11(2)14(12(3)9-10)15(16-4)13-6-5-7-13/h8-9,13,15-16H,5-7H2,1-4H3.
What are the key properties of 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine?
1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine has a molecular weight of 217.36 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine is sourced from PubChem (CID 43484275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).