5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine

C19H33NO — CID 105120818

IUPAC5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine
SMILESCCCNC(CCC(C)OC)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C19H33NO/c1-7-10-20-18(9-8-17(5)21-6)13-19-15(3)11-14(2)12-16(19)4/h11-12,17-18,20H,7-10,13H2,1-6H3
InChIKeyOZGJFGJZPMKKMA-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.34
Rot. Bonds9

About 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine

5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine (PubChem CID 105120818) has the molecular formula C19H33NO and a molecular weight of 291.48 g/mol. Its IUPAC name is 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine.

Molecular Properties

Compound Name5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine
PubChem CID105120818
Molecular FormulaC19H33NO
Molecular Weight291.48 g/mol
Exact Mass291.26
IUPAC Name5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine
SMILESCCCNC(CCC(C)OC)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C19H33NO/c1-7-10-20-18(9-8-17(5)21-6)13-19-15(3)11-14(2)12-16(19)4/h11-12,17-18,20H,7-10,13H2,1-6H3
InChIKeyOZGJFGJZPMKKMA-UHFFFAOYSA-N
XLogP4.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethoxy-N-propyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 105121210
1-N,1-N-dimethyl-2-N-propyl-3-(2,4,6-trimethylphenyl)propane-1,2-diamine
CID 79088757
1-(2,5-dimethylpyrazol-3-yl)-5-methoxy-N-propylhexan-2-amine
CID 105158544
1-methylsulfonyl-N-propyl-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 115601465
1-(3-chlorophenyl)-5-methoxy-N-propylhexan-2-amine
CID 105085865
1-(2,5-dimethylphenyl)-4-methoxy-N-propylpentan-1-amine
CID 105120183
1-(3,4-dimethylphenyl)-4-methoxy-N-propylpentan-1-amine
CID 105140268
N-propyl-1-thiophen-3-yl-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 105120984
1-(3,5-dimethylphenyl)-N-propylhexan-2-amine
CID 63416565
1-(3-chloro-4-pyridinyl)-5-methoxy-N-propylhexan-2-amine
CID 105157342
1-(2,6-dimethylphenyl)-N-propylheptan-2-amine
CID 105024635
4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 113391370

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine?
The IUPAC name of 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine (CID 105120818) is 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine.
What is the SMILES notation for 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine?
The canonical SMILES for 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine is CCCNC(CCC(C)OC)Cc1c(C)cc(C)cc1C.
What is the InChIKey of 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine?
The InChIKey is OZGJFGJZPMKKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NO/c1-7-10-20-18(9-8-17(5)21-6)13-19-15(3)11-14(2)12-16(19)4/h11-12,17-18,20H,7-10,13H2,1-6H3.
What are the key properties of 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine?
5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine has a molecular weight of 291.48 g/mol, XLogP of 4.34, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine is sourced from PubChem (CID 105120818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).