3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine

C15H18N2O — CID 2735321

IUPAC3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine
SMILESCc1ccc(C)c(COc2ccc(C)nc2N)c1
InChIInChI=1S/C15H18N2O/c1-10-4-5-11(2)13(8-10)9-18-14-7-6-12(3)17-15(14)16/h4-8H,9H2,1-3H3,(H2,16,17)
InChIKeyIYLWJTCYIKKOBV-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.17
Rot. Bonds3

About 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine

3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine (PubChem CID 2735321) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine
PubChem CID2735321
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine
SMILESCc1ccc(C)c(COc2ccc(C)nc2N)c1
InChIInChI=1S/C15H18N2O/c1-10-4-5-11(2)13(8-10)9-18-14-7-6-12(3)17-15(14)16/h4-8H,9H2,1-3H3,(H2,16,17)
InChIKeyIYLWJTCYIKKOBV-UHFFFAOYSA-N
XLogP3.17
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

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Related Compounds

3-[(2,4-difluorophenyl)methoxy]-6-methylpyridin-2-amine
CID 62197636
4-bromo-3-[(2,5-dimethylphenyl)methoxy]aniline
CID 103009356
6-methyl-3-[(5-methyl-3-pyridinyl)methoxy]pyridin-2-amine
CID 102880225
3-ethoxy-6-methylpyridin-2-amine
CID 54057030
2-[(2,5-dimethylphenyl)methoxy]-5-propan-2-ylaniline
CID 82134354
1,4-dimethyl-2-[(2-methylphenoxy)methyl]benzene
CID 60627928
6-methyl-3-[(3-methyl-2-pyridinyl)methoxy]pyridin-2-amine
CID 112649784
5-[(2,5-dimethylphenyl)methoxy]quinolin-8-amine
CID 116524807
3-[(2-amino-6-methyl-3-pyridinyl)oxymethyl]-4-fluorobenzonitrile
CID 55036974
3-[(3-chloro-2-fluorophenyl)methoxy]-6-methylpyridin-2-amine
CID 102855362
5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide
CID 106956236
1-[2-[(2,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanol
CID 61481674

Frequently Asked Questions

What is the IUPAC name of 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine?
The IUPAC name of 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine (CID 2735321) is 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine.
What is the SMILES notation for 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine?
The canonical SMILES for 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine is Cc1ccc(C)c(COc2ccc(C)nc2N)c1.
What is the InChIKey of 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine?
The InChIKey is IYLWJTCYIKKOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10-4-5-11(2)13(8-10)9-18-14-7-6-12(3)17-15(14)16/h4-8H,9H2,1-3H3,(H2,16,17).
What are the key properties of 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine?
3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine has a molecular weight of 242.32 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,5-dimethylphenyl)methoxy]-6-methylpyridin-2-amine is sourced from PubChem (CID 2735321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).