3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine

C19H31N — CID 43484245

IUPAC3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
SMILESCNC(CCC1CCCCC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C19H31N/c1-14-12-15(2)19(16(3)13-14)18(20-4)11-10-17-8-6-5-7-9-17/h12-13,17-18,20H,5-11H2,1-4H3
InChIKeyBDCPJEIBNULKLM-UHFFFAOYSA-N
MW273.46 g/mol
LogP5.23
Rot. Bonds5

About 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine

3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine (PubChem CID 43484245) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
PubChem CID43484245
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
SMILESCNC(CCC1CCCCC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C19H31N/c1-14-12-15(2)19(16(3)13-14)18(20-4)11-10-17-8-6-5-7-9-17/h12-13,17-18,20H,5-11H2,1-4H3
InChIKeyBDCPJEIBNULKLM-UHFFFAOYSA-N
XLogP5.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.46
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclopentyl-1-(2,4-dimethylphenyl)-N-methylpropan-1-amine
CID 43482676
3-cyclopentyl-N-methyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990513
3-cyclopentyl-N-ethyl-1-(2-fluoro-4,6-dimethylphenyl)propan-1-amine
CID 106883936
3-cyclopentyl-1-(3,5-dimethylthiophen-2-yl)-N-methylpropan-1-amine
CID 81155888
1-(5-chloro-4-methylthiophen-2-yl)-3-cyclohexyl-N-methylpropan-1-amine
CID 102763726
N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine
CID 43484222
3-cyclopentyl-N-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]propan-1-amine
CID 102757776
3-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 63506516
3-cyclohexyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
CID 114192965
1-(1-bromo-3-cyclohexylpropyl)-2,4-dimethylbenzene
CID 63438485
3-cyclopentyl-1-(3,5-dimethylphenyl)-N-ethylpropan-1-amine
CID 115796908
3-cyclopentyl-N-methyl-1-(3-methyl-4-pyridinyl)propan-1-amine
CID 114192227

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The IUPAC name of 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine (CID 43484245) is 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine.
What is the SMILES notation for 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The canonical SMILES for 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine is CNC(CCC1CCCCC1)c1c(C)cc(C)cc1C.
What is the InChIKey of 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The InChIKey is BDCPJEIBNULKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-14-12-15(2)19(16(3)13-14)18(20-4)11-10-17-8-6-5-7-9-17/h12-13,17-18,20H,5-11H2,1-4H3.
What are the key properties of 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine has a molecular weight of 273.46 g/mol, XLogP of 5.23, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine is sourced from PubChem (CID 43484245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).