4-methyl-3-(6-methyldodecan-6-yl)pyridine

C19H33N — CID 134177281

IUPAC4-methyl-3-(6-methyldodecan-6-yl)pyridine
SMILESCCCCCCC(C)(CCCCC)c1cnccc1C
InChIInChI=1S/C19H33N/c1-5-7-9-11-14-19(4,13-10-8-6-2)18-16-20-15-12-17(18)3/h12,15-16H,5-11,13-14H2,1-4H3
InChIKeyREDDGFZOMLQUSP-UHFFFAOYSA-N
MW275.48 g/mol
LogP6.20
Rot. Bonds10

About 4-methyl-3-(6-methyldodecan-6-yl)pyridine

4-methyl-3-(6-methyldodecan-6-yl)pyridine (PubChem CID 134177281) has the molecular formula C19H33N and a molecular weight of 275.48 g/mol. Its IUPAC name is 4-methyl-3-(6-methyldodecan-6-yl)pyridine.

Molecular Properties

Compound Name4-methyl-3-(6-methyldodecan-6-yl)pyridine
PubChem CID134177281
Molecular FormulaC19H33N
Molecular Weight275.48 g/mol
Exact Mass275.26
IUPAC Name4-methyl-3-(6-methyldodecan-6-yl)pyridine
SMILESCCCCCCC(C)(CCCCC)c1cnccc1C
InChIInChI=1S/C19H33N/c1-5-7-9-11-14-19(4,13-10-8-6-2)18-16-20-15-12-17(18)3/h12,15-16H,5-11,13-14H2,1-4H3
InChIKeyREDDGFZOMLQUSP-UHFFFAOYSA-N
XLogP6.20
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.48
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(5-methylundecan-5-yl)pyridine
CID 146178387
4-(7-methyltridecan-7-yl)pyrimidine
CID 126624853
2-(3-methylnonan-3-yl)pyrazine
CID 139342316
2-(4-methyl-3-pyridinyl)butan-2-ol
CID 66273296
3-dodecan-6-yl-4-methylpyridine
CID 129130745
4-(7-methyltridecan-7-yl)pyridazine
CID 146508245
3-(2-methyloctan-2-yl)pyridine
CID 126558457
4-heptyl-3-methylpyridine
CID 143666243
2-fluoro-3-(5-methylundecan-5-yl)pyridine
CID 139342335
1-(4-methyl-3-pyridinyl)octan-1-ol
CID 66273519
3-(5-methylnonan-5-yl)pyridine
CID 139543665
1-(4-methyl-3-pyridinyl)-1-phenylbutan-1-amine
CID 66274156

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(6-methyldodecan-6-yl)pyridine?
The IUPAC name of 4-methyl-3-(6-methyldodecan-6-yl)pyridine (CID 134177281) is 4-methyl-3-(6-methyldodecan-6-yl)pyridine.
What is the SMILES notation for 4-methyl-3-(6-methyldodecan-6-yl)pyridine?
The canonical SMILES for 4-methyl-3-(6-methyldodecan-6-yl)pyridine is CCCCCCC(C)(CCCCC)c1cnccc1C.
What is the InChIKey of 4-methyl-3-(6-methyldodecan-6-yl)pyridine?
The InChIKey is REDDGFZOMLQUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N/c1-5-7-9-11-14-19(4,13-10-8-6-2)18-16-20-15-12-17(18)3/h12,15-16H,5-11,13-14H2,1-4H3.
What are the key properties of 4-methyl-3-(6-methyldodecan-6-yl)pyridine?
4-methyl-3-(6-methyldodecan-6-yl)pyridine has a molecular weight of 275.48 g/mol, XLogP of 6.20, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(6-methyldodecan-6-yl)pyridine is sourced from PubChem (CID 134177281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).