3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine

C16H16N3O- — CID 163179161

IUPAC3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine
SMILESCC1(C)N=C(c2cccnc2)N([O-])C1c1ccccc1
InChIInChI=1S/C16H16N3O/c1-16(2)14(12-7-4-3-5-8-12)19(20)15(18-16)13-9-6-10-17-11-13/h3-11,14H,1-2H3/q-1
InChIKeyKZNUXXQNZIWZJK-UHFFFAOYSA-N
MW266.32 g/mol
LogP3.16
Rot. Bonds2

About 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine

3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine (PubChem CID 163179161) has the molecular formula C16H16N3O- and a molecular weight of 266.32 g/mol. Its IUPAC name is 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine.

Molecular Properties

Compound Name3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine
PubChem CID163179161
Molecular FormulaC16H16N3O-
Molecular Weight266.32 g/mol
Exact Mass266.13
IUPAC Name3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine
SMILESCC1(C)N=C(c2cccnc2)N([O-])C1c1ccccc1
InChIInChI=1S/C16H16N3O/c1-16(2)14(12-7-4-3-5-8-12)19(20)15(18-16)13-9-6-10-17-11-13/h3-11,14H,1-2H3/q-1
InChIKeyKZNUXXQNZIWZJK-UHFFFAOYSA-N
XLogP3.16
TPSA51.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4,4-dimethyl-1-oxido-5-phenylimidazol-1-ium-2-yl)pyridine
CID 928089
3-(3-hydroxy-4,4-dimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium-2-yl)pyridine
CID 2850564
5,5-dimethyl-6-phenyl-3-pyridin-3-yl-2H-1,2,4-triazine
CID 102265994
3-[(2R)-1-hydroxy-5,5-dimethyl-4-phenyl-2H-imidazol-2-yl]pyridine
CID 781274
3-(4,4-dimethyl-1,3-dioxido-5-phenylimidazole-1,3-diium-2-yl)pyridine
CID 14290449
3-(9,9,10,10-tetramethyl-3,6,7-tripyridin-3-ylanthracen-2-yl)pyridine
CID 59649089
3-(3,5-diphenylphenyl)pyridine
CID 141411458
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
(9S)-5,5-dimethyl-13-phenyl-9-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one
CID 41029383
3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine
CID 13292849
nitric acid;3-(1,5,5-trimethyl-4H-imidazol-2-yl)pyridine
CID 13414469
3-(1-methylpyrrol-2-yl)pyridine
CID 10249

Frequently Asked Questions

What is the IUPAC name of 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine?
The IUPAC name of 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine (CID 163179161) is 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine.
What is the SMILES notation for 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine?
The canonical SMILES for 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine is CC1(C)N=C(c2cccnc2)N([O-])C1c1ccccc1.
What is the InChIKey of 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine?
The InChIKey is KZNUXXQNZIWZJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N3O/c1-16(2)14(12-7-4-3-5-8-12)19(20)15(18-16)13-9-6-10-17-11-13/h3-11,14H,1-2H3/q-1.
What are the key properties of 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine?
3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine has a molecular weight of 266.32 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,5-dimethyl-3-oxido-4-phenyl-4H-imidazol-2-yl)pyridine is sourced from PubChem (CID 163179161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).