1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine

C14H23NO — CID 79198023

IUPAC1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine
SMILESCNC(c1cc(C)ccc1C)C(C)(C)OC
InChIInChI=1S/C14H23NO/c1-10-7-8-11(2)12(9-10)13(15-5)14(3,4)16-6/h7-9,13,15H,1-6H3
InChIKeyGLMDUTZMHZYDCR-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.99
Rot. Bonds4

About 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine

1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine (PubChem CID 79198023) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine
PubChem CID79198023
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine
SMILESCNC(c1cc(C)ccc1C)C(C)(C)OC
InChIInChI=1S/C14H23NO/c1-10-7-8-11(2)12(9-10)13(15-5)14(3,4)16-6/h7-9,13,15H,1-6H3
InChIKeyGLMDUTZMHZYDCR-UHFFFAOYSA-N
XLogP2.99
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-dimethylphenyl)-N,2,2-trimethylpropan-1-amine
CID 43483759
1-(2,5-dimethylphenyl)-2,2,2-trifluoro-N-methylethanamine
CID 43483752
1-(2,5-dimethylphenyl)-N,2,2-trimethylbutane-1,4-diamine
CID 116949958
1-(3,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine
CID 79197545
4-(2,5-dimethylphenyl)-3,3-dimethyl-4-(methylamino)butanoic acid
CID 116953536
2-methoxy-N,2-dimethyl-1-(2-methylthiophen-3-yl)propan-1-amine
CID 102833225
2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-N,2-dimethylpropan-1-amine
CID 106680743
1-(2-fluorophenyl)-2-methoxy-N,2-dimethylpropan-1-amine
CID 79197204
1-(2-methoxy-5-methylphenyl)-2-methyl-1-(methylamino)propan-2-ol
CID 116957172
1-(2,5-dimethylphenyl)-2,2-dimethyl-N-propylpropan-1-amine
CID 43496106
1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756
1-(2,5-dimethylphenyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 43483809

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine (CID 79198023) is 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine is CNC(c1cc(C)ccc1C)C(C)(C)OC.
What is the InChIKey of 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine?
The InChIKey is GLMDUTZMHZYDCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-10-7-8-11(2)12(9-10)13(15-5)14(3,4)16-6/h7-9,13,15H,1-6H3.
What are the key properties of 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine?
1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-2-methoxy-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 79198023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).