3-methyl-4-pyridin-2-yloxyaniline

C12H12N2O — CID 69194589

IUPAC3-methyl-4-pyridin-2-yloxyaniline
SMILESCc1cc(N)ccc1Oc1ccccn1
InChIInChI=1S/C12H12N2O/c1-9-8-10(13)5-6-11(9)15-12-4-2-3-7-14-12/h2-8H,13H2,1H3
InChIKeyJDFDKKFPCWNTQI-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.76
Rot. Bonds2

About 3-methyl-4-pyridin-2-yloxyaniline

3-methyl-4-pyridin-2-yloxyaniline (PubChem CID 69194589) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-methyl-4-pyridin-2-yloxyaniline.

Molecular Properties

Compound Name3-methyl-4-pyridin-2-yloxyaniline
PubChem CID69194589
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name3-methyl-4-pyridin-2-yloxyaniline
SMILESCc1cc(N)ccc1Oc1ccccn1
InChIInChI=1S/C12H12N2O/c1-9-8-10(13)5-6-11(9)15-12-4-2-3-7-14-12/h2-8H,13H2,1H3
InChIKeyJDFDKKFPCWNTQI-UHFFFAOYSA-N
XLogP2.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,5-dimethyl-4-pyridin-2-yloxyaniline
CID 129016357
5-amino-2-pyridin-2-yloxybenzonitrile
CID 61388646
4-[6-(aminomethyl)pyrimidin-4-yl]oxy-3-methylaniline
CID 68537192
4-[(5-methoxy-2-pyridinyl)oxy]-3-methylaniline
CID 106504339
4,5-dichloro-2-pyridin-2-yloxyaniline
CID 107501007
3-methyl-4-pyrazolo[1,5-a]pyrazin-4-yloxyaniline
CID 104732228
4-methyl-3-pyridin-2-yloxybenzoic acid
CID 55031137
4-methyl-3-pyridazin-3-yloxyaniline
CID 62482845
3-methyl-2-pyridin-2-yloxypyridine
CID 67923794
2-(3-methoxy-4-methylphenoxy)pyridine
CID 118928199
3-methyl-4-[2-(trifluoromethyl)phenoxy]aniline
CID 18616432
2-methyl-8-pyridin-2-yloxyquinoline
CID 23934989

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-pyridin-2-yloxyaniline?
The IUPAC name of 3-methyl-4-pyridin-2-yloxyaniline (CID 69194589) is 3-methyl-4-pyridin-2-yloxyaniline.
What is the SMILES notation for 3-methyl-4-pyridin-2-yloxyaniline?
The canonical SMILES for 3-methyl-4-pyridin-2-yloxyaniline is Cc1cc(N)ccc1Oc1ccccn1.
What is the InChIKey of 3-methyl-4-pyridin-2-yloxyaniline?
The InChIKey is JDFDKKFPCWNTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-8-10(13)5-6-11(9)15-12-4-2-3-7-14-12/h2-8H,13H2,1H3.
What are the key properties of 3-methyl-4-pyridin-2-yloxyaniline?
3-methyl-4-pyridin-2-yloxyaniline has a molecular weight of 200.24 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-pyridin-2-yloxyaniline is sourced from PubChem (CID 69194589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).