1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine

C17H22N2O — CID 106680494

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
SMILESCNC(c1ncccc1C)c1c(C)cc(C)cc1OC
InChIInChI=1S/C17H22N2O/c1-11-9-13(3)15(14(10-11)20-5)17(18-4)16-12(2)7-6-8-19-16/h6-10,17-18H,1-5H3
InChIKeyBPKOTHNVRWGFMP-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.32
Rot. Bonds4

About 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine

1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine (PubChem CID 106680494) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
PubChem CID106680494
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
SMILESCNC(c1ncccc1C)c1c(C)cc(C)cc1OC
InChIInChI=1S/C17H22N2O/c1-11-9-13(3)15(14(10-11)20-5)17(18-4)16-12(2)7-6-8-19-16/h6-10,17-18H,1-5H3
InChIKeyBPKOTHNVRWGFMP-UHFFFAOYSA-N
XLogP3.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 106680989
1-(4-chloro-3-methoxyphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
CID 79697755
1-(2-fluoro-3-methoxyphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
CID 82808124
1-(2-methoxy-4,6-dimethylphenyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 106680353
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 106680429
(1R)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylethanamine
CID 96670588
1-(3,5-dibromophenyl)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
CID 107977995
1-(2-fluoro-4-methylphenyl)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
CID 106682218
[(2-methoxy-4,6-dimethylphenyl)-pyridin-3-ylmethyl]hydrazine
CID 106682675
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(thiadiazol-5-yl)methanamine
CID 106682307
1-(furan-2-yl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
CID 63949984
[(2-methoxy-4,6-dimethylphenyl)-phenylmethyl]hydrazine
CID 106682684

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine (CID 106680494) is 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine is CNC(c1ncccc1C)c1c(C)cc(C)cc1OC.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine?
The InChIKey is BPKOTHNVRWGFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-11-9-13(3)15(14(10-11)20-5)17(18-4)16-12(2)7-6-8-19-16/h6-10,17-18H,1-5H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine?
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine has a molecular weight of 270.38 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 106680494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).