5-methoxy-2-(pyridin-2-ylmethoxy)aniline

C13H14N2O2 — CID 16775223

IUPAC5-methoxy-2-(pyridin-2-ylmethoxy)aniline
SMILESCOc1ccc(OCc2ccccn2)c(N)c1
InChIInChI=1S/C13H14N2O2/c1-16-11-5-6-13(12(14)8-11)17-9-10-4-2-3-7-15-10/h2-8H,9,14H2,1H3
InChIKeySAPFCEGFVZKBAZ-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.25
Rot. Bonds4

About 5-methoxy-2-(pyridin-2-ylmethoxy)aniline

5-methoxy-2-(pyridin-2-ylmethoxy)aniline (PubChem CID 16775223) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 5-methoxy-2-(pyridin-2-ylmethoxy)aniline.

Molecular Properties

Compound Name5-methoxy-2-(pyridin-2-ylmethoxy)aniline
PubChem CID16775223
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name5-methoxy-2-(pyridin-2-ylmethoxy)aniline
SMILESCOc1ccc(OCc2ccccn2)c(N)c1
InChIInChI=1S/C13H14N2O2/c1-16-11-5-6-13(12(14)8-11)17-9-10-4-2-3-7-15-10/h2-8H,9,14H2,1H3
InChIKeySAPFCEGFVZKBAZ-UHFFFAOYSA-N
XLogP2.25
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-5-(pyridin-2-ylmethoxy)aniline
CID 103201474
5-methoxy-2-[(6-methoxy-2-pyridinyl)methoxy]aniline
CID 63990956
N-[[5-methoxy-2-(pyridin-2-ylmethoxy)phenyl]methyl]propan-2-amine
CID 43276444
5-methoxy-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]aniline
CID 82891995
N-[[5-methoxy-2-(pyridin-2-ylmethoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 119129654
2-[(3,4,5-trimethoxyphenoxy)methyl]pyridine
CID 121304269
[5-methoxy-2-(pyrimidin-2-ylmethoxy)phenyl]methanamine
CID 62697998
2-methoxy-4-(2-pyridin-2-ylethoxy)aniline
CID 63678212
2-ethylsulfonyl-N-[[5-methoxy-2-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
CID 119112492
2-[(3-fluoro-4-methoxyphenyl)methoxy]-5-methoxyaniline
CID 43332349
2-[(4-iodophenyl)methoxy]-5-methoxyaniline
CID 65498773
2,5-dimethoxyaniline;molecular hydrogen
CID 159599481

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(pyridin-2-ylmethoxy)aniline?
The IUPAC name of 5-methoxy-2-(pyridin-2-ylmethoxy)aniline (CID 16775223) is 5-methoxy-2-(pyridin-2-ylmethoxy)aniline.
What is the SMILES notation for 5-methoxy-2-(pyridin-2-ylmethoxy)aniline?
The canonical SMILES for 5-methoxy-2-(pyridin-2-ylmethoxy)aniline is COc1ccc(OCc2ccccn2)c(N)c1.
What is the InChIKey of 5-methoxy-2-(pyridin-2-ylmethoxy)aniline?
The InChIKey is SAPFCEGFVZKBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-16-11-5-6-13(12(14)8-11)17-9-10-4-2-3-7-15-10/h2-8H,9,14H2,1H3.
What are the key properties of 5-methoxy-2-(pyridin-2-ylmethoxy)aniline?
5-methoxy-2-(pyridin-2-ylmethoxy)aniline has a molecular weight of 230.27 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(pyridin-2-ylmethoxy)aniline is sourced from PubChem (CID 16775223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).