3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol

C15H18N2O2 — CID 114936585

IUPAC3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol
SMILESCOc1ccc(CNc2ccc(C)c(O)c2C)cn1
InChIInChI=1S/C15H18N2O2/c1-10-4-6-13(11(2)15(10)18)16-8-12-5-7-14(19-3)17-9-12/h4-7,9,16,18H,8H2,1-3H3
InChIKeyZAYSACYEIHCPLR-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.02
Rot. Bonds4

About 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol

3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol (PubChem CID 114936585) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol.

Molecular Properties

Compound Name3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol
PubChem CID114936585
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol
SMILESCOc1ccc(CNc2ccc(C)c(O)c2C)cn1
InChIInChI=1S/C15H18N2O2/c1-10-4-6-13(11(2)15(10)18)16-8-12-5-7-14(19-3)17-9-12/h4-7,9,16,18H,8H2,1-3H3
InChIKeyZAYSACYEIHCPLR-UHFFFAOYSA-N
XLogP3.02
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethoxy-N-[(6-methoxy-3-pyridinyl)methyl]-2-methylaniline
CID 114936663
3-[(4-ethylphenyl)methylamino]-2,6-dimethylphenol
CID 43741705
3-[(3,4-dimethylphenyl)methylamino]-2,6-dimethylphenol
CID 43790197
2,3,4-trifluoro-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936281
2-chloro-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylaniline
CID 114936385
3-[(6-methoxy-3-pyridinyl)methylamino]-N,2-dimethylbenzamide
CID 114936559
4-[(6-methoxy-3-pyridinyl)methylamino]-N,3-dimethylbenzamide
CID 114936579
ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine
CID 143898459
3-iodo-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylaniline
CID 114936508
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62292084
3-[(4-cyclopropylphenyl)methylamino]-2,6-dimethylphenol
CID 79978851
4-chloro-N-[(6-methoxy-3-pyridinyl)methyl]pyridin-3-amine
CID 114936877

Frequently Asked Questions

What is the IUPAC name of 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol?
The IUPAC name of 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol (CID 114936585) is 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol.
What is the SMILES notation for 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol?
The canonical SMILES for 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol is COc1ccc(CNc2ccc(C)c(O)c2C)cn1.
What is the InChIKey of 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol?
The InChIKey is ZAYSACYEIHCPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10-4-6-13(11(2)15(10)18)16-8-12-5-7-14(19-3)17-9-12/h4-7,9,16,18H,8H2,1-3H3.
What are the key properties of 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol?
3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol has a molecular weight of 258.32 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol is sourced from PubChem (CID 114936585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).