3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine

C16H16N4 — CID 102970594

IUPAC3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine
SMILESCc1cc(C)cc(-c2cnc(-c3cnccc3N)[nH]2)c1
InChIInChI=1S/C16H16N4/c1-10-5-11(2)7-12(6-10)15-9-19-16(20-15)13-8-18-4-3-14(13)17/h3-9H,1-2H3,(H2,17,18)(H,19,20)
InChIKeyQAHLKPLTAWWZSS-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.34
Rot. Bonds2

About 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine

3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine (PubChem CID 102970594) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine.

Molecular Properties

Compound Name3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine
PubChem CID102970594
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine
SMILESCc1cc(C)cc(-c2cnc(-c3cnccc3N)[nH]2)c1
InChIInChI=1S/C16H16N4/c1-10-5-11(2)7-12(6-10)15-9-19-16(20-15)13-8-18-4-3-14(13)17/h3-9H,1-2H3,(H2,17,18)(H,19,20)
InChIKeyQAHLKPLTAWWZSS-UHFFFAOYSA-N
XLogP3.34
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(4-fluoro-3-methylphenyl)-1H-imidazol-2-yl]pyridin-4-amine
CID 102970530
5-bromo-2-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]aniline
CID 103386879
2-bromo-4-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-3-amine
CID 103386873
3-(3,5-dimethylphenyl)-4-methylpyridine
CID 102097764
4-methyl-3-(2-pyridin-3-yl-1H-imidazol-5-yl)pyridine
CID 86217259
4-methyl-5-[3-(5-phenyl-1H-imidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 135992344
4-chloro-2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]aniline
CID 103386914
4-[5-(3,5-dichlorophenyl)-1H-imidazol-2-yl]pyridine
CID 151427943
3-methyl-5-pyrazin-2-ylaniline
CID 107579564
3-[2-(4-ethyl-3-pyridinyl)-1H-imidazol-5-yl]benzonitrile
CID 86217266
5-(3-methylphenyl)-1H-imidazol-2-amine
CID 66202111
2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-5-methoxyaniline
CID 143932131

Frequently Asked Questions

What is the IUPAC name of 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine?
The IUPAC name of 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine (CID 102970594) is 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine.
What is the SMILES notation for 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine?
The canonical SMILES for 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine is Cc1cc(C)cc(-c2cnc(-c3cnccc3N)[nH]2)c1.
What is the InChIKey of 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine?
The InChIKey is QAHLKPLTAWWZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-10-5-11(2)7-12(6-10)15-9-19-16(20-15)13-8-18-4-3-14(13)17/h3-9H,1-2H3,(H2,17,18)(H,19,20).
What are the key properties of 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine?
3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine has a molecular weight of 264.33 g/mol, XLogP of 3.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]pyridin-4-amine is sourced from PubChem (CID 102970594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).