2,3-ditert-butyl-3-methyl-2H-pyridine

C14H25N — CID 67707010

IUPAC2,3-ditert-butyl-3-methyl-2H-pyridine
SMILESCC(C)(C)C1N=CC=CC1(C)C(C)(C)C
InChIInChI=1S/C14H25N/c1-12(2,3)11-14(7,13(4,5)6)9-8-10-15-11/h8-11H,1-7H3
InChIKeyMXYRNHRYDDCDME-UHFFFAOYSA-N
MW207.36 g/mol
LogP4.09
Rot. Bonds

About 2,3-ditert-butyl-3-methyl-2H-pyridine

2,3-ditert-butyl-3-methyl-2H-pyridine (PubChem CID 67707010) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2,3-ditert-butyl-3-methyl-2H-pyridine.

Molecular Properties

Compound Name2,3-ditert-butyl-3-methyl-2H-pyridine
PubChem CID67707010
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2,3-ditert-butyl-3-methyl-2H-pyridine
SMILESCC(C)(C)C1N=CC=CC1(C)C(C)(C)C
InChIInChI=1S/C14H25N/c1-12(2,3)11-14(7,13(4,5)6)9-8-10-15-11/h8-11H,1-7H3
InChIKeyMXYRNHRYDDCDME-UHFFFAOYSA-N
XLogP4.09
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-Diethyl-2,3-dihydropyridine
CID 53814937
3-Tert-butyl-5-fluoro-2-methyl-2,3-dihydropyridine
CID 126590908
2-tert-butyl-3,3-dimethyl-4-(trifluoromethyl)-2H-pyridine
CID 157857164
2-Tert-butyl-2,3-dihydropyridine
CID 59160947
2,3-Di(propan-2-yl)-2,3-dihydropyridine
CID 59427901
2,3-Bis(prop-2-enyl)-2,3-dihydropyridine
CID 67802550
2,4-diethyl-3-methyl-3,4-dihydro-2H-azepine
CID 68391441
3-methyl-2-propan-2-yl-3,4-dihydro-2H-azepine
CID 69923477
2-(3-Methylbutan-2-yl)-1-azacyclododeca-4,8,12-triene
CID 70531114
4a-methyl-6,8a-dihydro-5H-quinoline
CID 89241057
(2R)-3-methyl-2-propan-2-yl-3,4-dihydro-2H-azepine
CID 89243825
2-Tert-butyl-5-(2,4,4-trimethylpentan-2-yl)-2,3-dihydropyridine
CID 89988986

Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-3-methyl-2H-pyridine?
The IUPAC name of 2,3-ditert-butyl-3-methyl-2H-pyridine (CID 67707010) is 2,3-ditert-butyl-3-methyl-2H-pyridine.
What is the SMILES notation for 2,3-ditert-butyl-3-methyl-2H-pyridine?
The canonical SMILES for 2,3-ditert-butyl-3-methyl-2H-pyridine is CC(C)(C)C1N=CC=CC1(C)C(C)(C)C.
What is the InChIKey of 2,3-ditert-butyl-3-methyl-2H-pyridine?
The InChIKey is MXYRNHRYDDCDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-12(2,3)11-14(7,13(4,5)6)9-8-10-15-11/h8-11H,1-7H3.
What are the key properties of 2,3-ditert-butyl-3-methyl-2H-pyridine?
2,3-ditert-butyl-3-methyl-2H-pyridine has a molecular weight of 207.36 g/mol, XLogP of 4.09, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-3-methyl-2H-pyridine is sourced from PubChem (CID 67707010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).