4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine

C15H25NO — CID 113391370

IUPAC4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine
SMILESCOC(C)CC(N)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C15H25NO/c1-10-6-11(2)15(12(3)7-10)9-14(16)8-13(4)17-5/h6-7,13-14H,8-9,16H2,1-5H3
InChIKeyDZUHMPSWMAOBTR-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.91
Rot. Bonds5

About 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine

4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine (PubChem CID 113391370) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine.

Molecular Properties

Compound Name4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine
PubChem CID113391370
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine
SMILESCOC(C)CC(N)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C15H25NO/c1-10-6-11(2)15(12(3)7-10)9-14(16)8-13(4)17-5/h6-7,13-14H,8-9,16H2,1-5H3
InChIKeyDZUHMPSWMAOBTR-UHFFFAOYSA-N
XLogP2.91
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-(2,4,6-trimethylphenyl)propan-1-ol;hydrochloride
CID 170891844
3-methoxy-1-(2,4,6-trimethylphenyl)butan-2-ol
CID 79616533
3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 63716659
1-(2,2,2-trifluoroethoxy)-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 103214849
4-methylsulfanyl-1-(2,4,6-trimethylphenyl)butan-2-amine
CID 105121218
3-methoxy-N-methyl-1-(2,4,6-trimethylphenyl)butan-2-amine
CID 79615967
[1,1-dimethoxy-3-(2,4,6-trimethylphenyl)propan-2-yl]hydrazine
CID 105246156
5-methoxy-N-propyl-1-(2,4,6-trimethylphenyl)hexan-2-amine
CID 105120818
1-N,1-N-diethyl-4-(2,4,6-trimethylphenyl)butane-1,3-diamine
CID 79086831
1-(3-methylphenyl)-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 63414918
dimethyl 2-[(2,4,6-trimethylphenyl)methyl]propanedioate
CID 94276263
1-(4-methoxy-2,6-dimethylphenyl)butan-2-amine
CID 82255191

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The IUPAC name of 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine (CID 113391370) is 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine.
What is the SMILES notation for 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The canonical SMILES for 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine is COC(C)CC(N)Cc1c(C)cc(C)cc1C.
What is the InChIKey of 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The InChIKey is DZUHMPSWMAOBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-10-6-11(2)15(12(3)7-10)9-14(16)8-13(4)17-5/h6-7,13-14H,8-9,16H2,1-5H3.
What are the key properties of 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine?
4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine is sourced from PubChem (CID 113391370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).