3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine

C15H13FN4 — CID 114716848

IUPAC3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine
SMILESCc1cc(F)ccc1-n1cncc1-c1cnccc1N
InChIInChI=1S/C15H13FN4/c1-10-6-11(16)2-3-14(10)20-9-19-8-15(20)12-7-18-5-4-13(12)17/h2-9H,1H3,(H2,17,18)
InChIKeyNPBKXHOHNQHGSQ-UHFFFAOYSA-N
MW268.30 g/mol
LogP2.96
Rot. Bonds2

About 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine

3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine (PubChem CID 114716848) has the molecular formula C15H13FN4 and a molecular weight of 268.30 g/mol. Its IUPAC name is 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine.

Molecular Properties

Compound Name3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine
PubChem CID114716848
Molecular FormulaC15H13FN4
Molecular Weight268.30 g/mol
Exact Mass268.11
IUPAC Name3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine
SMILESCc1cc(F)ccc1-n1cncc1-c1cnccc1N
InChIInChI=1S/C15H13FN4/c1-10-6-11(16)2-3-14(10)20-9-19-8-15(20)12-7-18-5-4-13(12)17/h2-9H,1H3,(H2,17,18)
InChIKeyNPBKXHOHNQHGSQ-UHFFFAOYSA-N
XLogP2.96
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-(4-methyl-3-pyridinyl)imidazol-4-yl]pyridin-4-amine
CID 114720350
3-[3-(2,5-dimethylphenyl)imidazol-4-yl]pyridin-4-amine
CID 114716803
3-[3-(2,3,4-trifluorophenyl)imidazol-4-yl]pyridin-4-amine
CID 114716552
3-[3-(2,6-dimethyl-3-pyridinyl)imidazol-4-yl]pyridin-4-amine
CID 114721205
3-[3-(3,4-dimethylphenyl)imidazol-4-yl]pyridin-4-amine
CID 114717015
3-[3-(2-methylsulfanylphenyl)imidazol-4-yl]pyridin-4-amine
CID 107649079
3-[3-(3-chloro-2-fluorophenyl)imidazol-4-yl]pyridin-4-amine
CID 114717814
3-[3-(3-methylphenyl)imidazol-4-yl]pyridin-4-amine
CID 114717514
3-[3-(4-bromo-3-fluorophenyl)imidazol-4-yl]pyridin-4-amine
CID 114720772
3-(2-amino-4-fluorophenyl)pyridin-4-amine
CID 154474291
4-[5-(6-amino-3-pyridinyl)imidazol-1-yl]-3-methylphenol
CID 114720896
3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine
CID 114717841

Frequently Asked Questions

What is the IUPAC name of 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine?
The IUPAC name of 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine (CID 114716848) is 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine.
What is the SMILES notation for 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine?
The canonical SMILES for 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine is Cc1cc(F)ccc1-n1cncc1-c1cnccc1N.
What is the InChIKey of 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine?
The InChIKey is NPBKXHOHNQHGSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4/c1-10-6-11(16)2-3-14(10)20-9-19-8-15(20)12-7-18-5-4-13(12)17/h2-9H,1H3,(H2,17,18).
What are the key properties of 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine?
3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine has a molecular weight of 268.30 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine is sourced from PubChem (CID 114716848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).