1,4-dimethyl-2H-pyridine

C7H11N — CID 13496664

IUPAC1,4-dimethyl-2H-pyridine
SMILESCC1=CCN(C)C=C1
InChIInChI=1S/C7H11N/c1-7-3-5-8(2)6-4-7/h3-5H,6H2,1-2H3
InChIKeyRZRQBRMLTFIIND-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.39
Rot. Bonds

About 1,4-dimethyl-2H-pyridine

1,4-dimethyl-2H-pyridine (PubChem CID 13496664) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 1,4-dimethyl-2H-pyridine.

Molecular Properties

Compound Name1,4-dimethyl-2H-pyridine
PubChem CID13496664
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name1,4-dimethyl-2H-pyridine
SMILESCC1=CCN(C)C=C1
InChIInChI=1S/C7H11N/c1-7-3-5-8(2)6-4-7/h3-5H,6H2,1-2H3
InChIKeyRZRQBRMLTFIIND-UHFFFAOYSA-N
XLogP1.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N'-dimethyl-4,4'-bipyridine
CID 12391261
1-Methyl-1,2-dihydropyridine
CID 12565502
1-Methyl-4-methylene-1,4-dihydropyridine
CID 23534281
2-(Cyclopenta-2,4-dien-1-ylidene)-1-methyl-1,2-dihydropyridine
CID 13860310
4-Methyl dihydropyridine
CID 407036
n-Vinyl pyridine
CID 12371303
1,3-Dimethylpyridine
CID 12437839
3-Ethyl-1-methyl-1,2-dihydropyridine
CID 12506166
5-ethyl-1-methyl-2H-pyridine
CID 12506167
1-Ethylpyridine
CID 18172714
2-(1-Methyl-4-pyridinylidene)acetonitrile
CID 20307987
N-butyl-4-methylpyridine
CID 20650803

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2H-pyridine?
The IUPAC name of 1,4-dimethyl-2H-pyridine (CID 13496664) is 1,4-dimethyl-2H-pyridine.
What is the SMILES notation for 1,4-dimethyl-2H-pyridine?
The canonical SMILES for 1,4-dimethyl-2H-pyridine is CC1=CCN(C)C=C1.
What is the InChIKey of 1,4-dimethyl-2H-pyridine?
The InChIKey is RZRQBRMLTFIIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-7-3-5-8(2)6-4-7/h3-5H,6H2,1-2H3.
What are the key properties of 1,4-dimethyl-2H-pyridine?
1,4-dimethyl-2H-pyridine has a molecular weight of 109.17 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2H-pyridine is sourced from PubChem (CID 13496664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).