4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine

C15H16N4 — CID 102215677

IUPAC4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine
SMILESCc1cc(C(=[N+]=[N-])c2cc(C)nc(C)c2)cc(C)n1
InChIInChI=1S/C15H16N4/c1-9-5-13(6-10(2)17-9)15(19-16)14-7-11(3)18-12(4)8-14/h5-8H,1-4H3
InChIKeyKFHGZAAUGOKQOI-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.78
Rot. Bonds2

About 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine

4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine (PubChem CID 102215677) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine
PubChem CID102215677
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine
SMILESCc1cc(C(=[N+]=[N-])c2cc(C)nc(C)c2)cc(C)n1
InChIInChI=1S/C15H16N4/c1-9-5-13(6-10(2)17-9)15(19-16)14-7-11(3)18-12(4)8-14/h5-8H,1-4H3
InChIKeyKFHGZAAUGOKQOI-UHFFFAOYSA-N
XLogP2.78
TPSA62.18 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

sulfane;2,4,6-trimethylpyridine
CID 69294176
(2,6-dimethyl-4-pyridinyl)methanediol
CID 146515076
3-(dimethylamino)-1-(2,6-dimethyl-4-pyridinyl)propan-1-one
CID 130407441
2-(2,6-dimethyl-4-pyridinyl)-2-hydroxyacetic acid
CID 82408630
CID 173082866
CID 173082866
butyl 2,6-dimethylpyridine-4-carboxylate
CID 66665942
2-bromo-1-(3,5-dimethylphenyl)-2-(2,6-dimethyl-4-pyridinyl)ethanone
CID 22282279
CID 58353914
CID 58353914
2-bromo-6-methylpyridine-4-carboxamide
CID 87482032
2-chloro-6-methylpyridine-4-carboxamide
CID 59534429
4-[(2E,4Z)-hexa-2,4-dien-3-yl]oxy-2,6-dimethylpyridine
CID 146419743
1-(2,6-dimethyl-4-pyridinyl)-4-ethylsulfonylbutan-1-one
CID 107502536

Frequently Asked Questions

What is the IUPAC name of 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine?
The IUPAC name of 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine (CID 102215677) is 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine.
What is the SMILES notation for 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine?
The canonical SMILES for 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine is Cc1cc(C(=[N+]=[N-])c2cc(C)nc(C)c2)cc(C)n1.
What is the InChIKey of 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine?
The InChIKey is KFHGZAAUGOKQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-9-5-13(6-10(2)17-9)15(19-16)14-7-11(3)18-12(4)8-14/h5-8H,1-4H3.
What are the key properties of 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine?
4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine has a molecular weight of 252.32 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[diazo-(2,6-dimethyl-4-pyridinyl)methyl]-2,6-dimethylpyridine is sourced from PubChem (CID 102215677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).