2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine

C15H25NO2 — CID 116718746

IUPAC2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine
SMILESCCCC(OC)C(NC)c1cc(C)ccc1OC
InChIInChI=1S/C15H25NO2/c1-6-7-14(18-5)15(16-3)12-10-11(2)8-9-13(12)17-4/h8-10,14-16H,6-7H2,1-5H3
InChIKeyKQMRAQROHZAGRJ-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.08
Rot. Bonds7

About 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine

2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine (PubChem CID 116718746) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine.

Molecular Properties

Compound Name2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine
PubChem CID116718746
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine
SMILESCCCC(OC)C(NC)c1cc(C)ccc1OC
InChIInChI=1S/C15H25NO2/c1-6-7-14(18-5)15(16-3)12-10-11(2)8-9-13(12)17-4/h8-10,14-16H,6-7H2,1-5H3
InChIKeyKQMRAQROHZAGRJ-UHFFFAOYSA-N
XLogP3.08
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-5-methylphenyl)-N-methylbutan-1-amine
CID 43626227
1-(2,4-dimethoxyphenyl)-2-methoxy-N-methylpentan-1-amine
CID 116718984
[1-(5-chloro-2-methoxyphenyl)-2-methoxypentyl]hydrazine
CID 105271901
1-(2-ethoxy-5-methylphenyl)-N,2-dimethylpentan-1-amine
CID 62303499
(1R)-1-(2-methoxy-5-methylphenyl)butan-1-amine
CID 55278250
2-[(2-methoxy-5-methylphenyl)-(methylamino)methyl]butanoic acid
CID 116959674
2-ethoxy-1-(2-methoxy-5-methylphenyl)-N,3,3-trimethylbutan-1-amine
CID 116725452
2-ethoxy-1-(2-methoxyphenyl)-N-methylpentan-1-amine
CID 116717712
2-methoxy-N-methyl-1-(2-methylthiophen-3-yl)pentan-1-amine
CID 102833855
1-(2-fluoro-5-methylphenyl)-2-methoxy-N-methylbutan-1-amine
CID 116715348
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 83155274
2-ethoxy-1-(2-methoxy-5-methylphenyl)-N-propylpropan-1-amine
CID 64535027

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine?
The IUPAC name of 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine (CID 116718746) is 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine.
What is the SMILES notation for 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine?
The canonical SMILES for 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine is CCCC(OC)C(NC)c1cc(C)ccc1OC.
What is the InChIKey of 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine?
The InChIKey is KQMRAQROHZAGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-6-7-14(18-5)15(16-3)12-10-11(2)8-9-13(12)17-4/h8-10,14-16H,6-7H2,1-5H3.
What are the key properties of 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine?
2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpentan-1-amine is sourced from PubChem (CID 116718746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).