2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline

C14H14N4O — CID 103385875

IUPAC2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline
SMILESCc1cc(Oc2nccc3c2ncn3C)ccc1N
InChIInChI=1S/C14H14N4O/c1-9-7-10(3-4-11(9)15)19-14-13-12(5-6-16-14)18(2)8-17-13/h3-8H,15H2,1-2H3
InChIKeyJSUBBUJEWRCZSS-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.65
Rot. Bonds2

About 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline

2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline (PubChem CID 103385875) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline.

Molecular Properties

Compound Name2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline
PubChem CID103385875
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline
SMILESCc1cc(Oc2nccc3c2ncn3C)ccc1N
InChIInChI=1S/C14H14N4O/c1-9-7-10(3-4-11(9)15)19-14-13-12(5-6-16-14)18(2)8-17-13/h3-8H,15H2,1-2H3
InChIKeyJSUBBUJEWRCZSS-UHFFFAOYSA-N
XLogP2.65
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.65
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

[4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyphenyl]methanamine
CID 103386242
2-methyl-3-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline
CID 103385883
4-(2-bromo-4-methylphenoxy)-1-methylimidazo[4,5-c]pyridine
CID 103385294
5-ethyl-2-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline
CID 103385898
3-(4-amino-3-methylphenoxy)pyrazine-2-carbonitrile
CID 62672549
4-(4-amino-3-methylphenoxy)pyridine-2-carbonitrile
CID 55156270
3-(4-amino-3-methylphenoxy)pyridazine-4-carbonitrile
CID 80514822
2-methyl-4-quinazolin-4-yloxyaniline
CID 60895454
2-methyl-4-(3-methylquinoxalin-2-yl)oxyaniline
CID 62375215
4-[7-(4-amino-3-methylphenoxy)naphthalen-2-yl]oxy-2-methylaniline
CID 139654231
1-[(1-methylimidazo[4,5-c]pyridin-4-yl)oxymethyl]cyclopentan-1-amine
CID 103386304
2-methyl-4-pyridin-3-yloxyaniline;hydrochloride
CID 156593409

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline?
The IUPAC name of 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline (CID 103385875) is 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline.
What is the SMILES notation for 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline?
The canonical SMILES for 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline is Cc1cc(Oc2nccc3c2ncn3C)ccc1N.
What is the InChIKey of 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline?
The InChIKey is JSUBBUJEWRCZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-7-10(3-4-11(9)15)19-14-13-12(5-6-16-14)18(2)8-17-13/h3-8H,15H2,1-2H3.
What are the key properties of 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline?
2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline has a molecular weight of 254.29 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(1-methylimidazo[4,5-c]pyridin-4-yl)oxyaniline is sourced from PubChem (CID 103385875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).