2,6-ditert-butyl-1-methyl-2H-pyridine

C14H25N — CID 53444027

IUPAC2,6-ditert-butyl-1-methyl-2H-pyridine
SMILESCN1C(C(C)(C)C)=CC=CC1C(C)(C)C
InChIInChI=1S/C14H25N/c1-13(2,3)11-9-8-10-12(15(11)7)14(4,5)6/h8-11H,1-7H3
InChIKeyPWIXQWXSWQWBLK-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.83
Rot. Bonds

About 2,6-ditert-butyl-1-methyl-2H-pyridine

2,6-ditert-butyl-1-methyl-2H-pyridine (PubChem CID 53444027) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2,6-ditert-butyl-1-methyl-2H-pyridine.

Molecular Properties

Compound Name2,6-ditert-butyl-1-methyl-2H-pyridine
PubChem CID53444027
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2,6-ditert-butyl-1-methyl-2H-pyridine
SMILESCN1C(C(C)(C)C)=CC=CC1C(C)(C)C
InChIInChI=1S/C14H25N/c1-13(2,3)11-9-8-10-12(15(11)7)14(4,5)6/h8-11H,1-7H3
InChIKeyPWIXQWXSWQWBLK-UHFFFAOYSA-N
XLogP3.83
TPSA3.24 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 ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Tert-butyl-8-methyl-10,10a-dihydropyrido[1,2-a]azepine
CID 10878547
4,8-Dimethyl-10,10a-dihydropyrido[1,2-a]azepine
CID 21597242
4,8,10a-trimethyl-10H-pyrido[1,2-a]azepine
CID 21597247
1,4-Di-t-butylpyridine
CID 66942442
5-fluoro-N,4,4-trimethyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine
CID 126590863
5-Tert-butyl-1-(1-fluoroethyl)-2-methylidenepyridine
CID 134559782
N-but-1-en-2-yl-3-fluoro-6-methyl-N-propylcyclohexa-2,4-dien-1-amine
CID 142020198
Diisopropylaminofulvene
CID 129814678
1-Diethylaminostyrene
CID 129871574
(2S)-1,2-dimethyl-6-[(2R)-pent-4-en-2-yl]-2H-pyridine
CID 134838483
(2S)-2-tert-butyl-1-methyl-2H-pyridine;carbon monoxide;chromium
CID 134981467
2-fluoro-3,3-dimethyl-N,N-dipropylcyclohexa-1,5-dien-1-amine
CID 144915718

Frequently Asked Questions

What is the IUPAC name of 2,6-ditert-butyl-1-methyl-2H-pyridine?
The IUPAC name of 2,6-ditert-butyl-1-methyl-2H-pyridine (CID 53444027) is 2,6-ditert-butyl-1-methyl-2H-pyridine.
What is the SMILES notation for 2,6-ditert-butyl-1-methyl-2H-pyridine?
The canonical SMILES for 2,6-ditert-butyl-1-methyl-2H-pyridine is CN1C(C(C)(C)C)=CC=CC1C(C)(C)C.
What is the InChIKey of 2,6-ditert-butyl-1-methyl-2H-pyridine?
The InChIKey is PWIXQWXSWQWBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-13(2,3)11-9-8-10-12(15(11)7)14(4,5)6/h8-11H,1-7H3.
What are the key properties of 2,6-ditert-butyl-1-methyl-2H-pyridine?
2,6-ditert-butyl-1-methyl-2H-pyridine has a molecular weight of 207.36 g/mol, XLogP of 3.83, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-ditert-butyl-1-methyl-2H-pyridine is sourced from PubChem (CID 53444027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).