5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline

C15H18N2O3 — CID 82891995

IUPAC5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline
SMILESCOc1cc(C)nc(COc2ccc(OC)cc2N)c1
InChIInChI=1S/C15H18N2O3/c1-10-6-13(19-3)7-11(17-10)9-20-15-5-4-12(18-2)8-14(15)16/h4-8H,9,16H2,1-3H3
InChIKeyKECKVVGBJKGPSR-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.57
Rot. Bonds5

About 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline

5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline (PubChem CID 82891995) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline.

Molecular Properties

Compound Name5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline
PubChem CID82891995
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline
SMILESCOc1cc(C)nc(COc2ccc(OC)cc2N)c1
InChIInChI=1S/C15H18N2O3/c1-10-6-13(19-3)7-11(17-10)9-20-15-5-4-12(18-2)8-14(15)16/h4-8H,9,16H2,1-3H3
InChIKeyKECKVVGBJKGPSR-UHFFFAOYSA-N
XLogP2.57
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(chloromethyl)-4-methoxyphenoxy]methyl]-4-methoxy-6-methylpyridine
CID 82888902
2-[[2-(chloromethyl)-5-methoxyphenoxy]methyl]-4-methoxy-6-methylpyridine
CID 82885946
4-chloro-3-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline
CID 82891927
5-methoxy-2-[(6-methoxy-2-pyridinyl)methoxy]aniline
CID 63990956
2-[(5-chloro-2-methylphenoxy)methyl]-4-methoxy-6-methylpyridine
CID 82895251
1-[5-amino-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanone
CID 116541105
5-methoxy-2-(pyridin-2-ylmethoxy)aniline
CID 16775223
(1R)-1-[2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
CID 82887878
2-amino-5-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]benzoic acid
CID 107076898
2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]-5-methylbenzaldehyde
CID 82893166
O-[(4-methoxy-6-methyl-2-pyridinyl)methyl]hydroxylamine
CID 82893104
3-[2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]prop-2-yn-1-amine
CID 82884234

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline?
The IUPAC name of 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline (CID 82891995) is 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline.
What is the SMILES notation for 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline?
The canonical SMILES for 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline is COc1cc(C)nc(COc2ccc(OC)cc2N)c1.
What is the InChIKey of 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline?
The InChIKey is KECKVVGBJKGPSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10-6-13(19-3)7-11(17-10)9-20-15-5-4-12(18-2)8-14(15)16/h4-8H,9,16H2,1-3H3.
What are the key properties of 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline?
5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline has a molecular weight of 274.32 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline is sourced from PubChem (CID 82891995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).