6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine

C18H25N — CID 143485899

IUPAC6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine
SMILESCC(C)C(C)(C)c1ccccc1C1=CC=CCN1C
InChIInChI=1S/C18H25N/c1-14(2)18(3,4)16-11-7-6-10-15(16)17-12-8-9-13-19(17)5/h6-12,14H,13H2,1-5H3
InChIKeyBRKGXGOWUFYTMX-UHFFFAOYSA-N
MW255.41 g/mol
LogP4.46
Rot. Bonds3

About 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine

6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine (PubChem CID 143485899) has the molecular formula C18H25N and a molecular weight of 255.41 g/mol. Its IUPAC name is 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine.

Molecular Properties

Compound Name6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine
PubChem CID143485899
Molecular FormulaC18H25N
Molecular Weight255.41 g/mol
Exact Mass255.20
IUPAC Name6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine
SMILESCC(C)C(C)(C)c1ccccc1C1=CC=CCN1C
InChIInChI=1S/C18H25N/c1-14(2)18(3,4)16-11-7-6-10-15(16)17-12-8-9-13-19(17)5/h6-12,14H,13H2,1-5H3
InChIKeyBRKGXGOWUFYTMX-UHFFFAOYSA-N
XLogP4.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dimethylbutan-2-yl)-2-methylbenzene
CID 14195588
1-methyl-6-propan-2-yl-2H-pyridine
CID 56628692
S-ethyl 2-[2-(2,3-dimethylbutan-2-yl)phenyl]benzenecarbothioate
CID 176708794
1-methyl-N,N-di(propan-2-yl)-2H-pyridin-6-amine
CID 56630542
4H-pyrido[2,1-a]phthalazine
CID 172823650
ethane;1-[3-methyl-3-[2-[(2Z)-3-methyl-4-phenylpenta-2,4-dienyl]phenyl]pentan-2-yl]-6-(2-methylphenyl)-2H-pyridine
CID 144579286
1-methyl-6-(2-methylcyclohexa-1,3-dien-1-yl)-2H-pyridine
CID 149026209
tris(2-tert-butylphenyl)phosphane
CID 11475937
6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine
CID 123461813
N-[2-(2-cyclopenta-1,3-dien-1-ylphenyl)propan-2-yl]aniline
CID 68546854
ethoxy-[2-(1-octadecyl-2H-pyridin-6-yl)phenyl]borinic acid
CID 91442922
4-(2,3-dimethylbutan-2-yl)-2,3-dihydro-1-benzofuran
CID 177208658

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine?
The IUPAC name of 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine (CID 143485899) is 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine.
What is the SMILES notation for 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine?
The canonical SMILES for 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine is CC(C)C(C)(C)c1ccccc1C1=CC=CCN1C.
What is the InChIKey of 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine?
The InChIKey is BRKGXGOWUFYTMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-14(2)18(3,4)16-11-7-6-10-15(16)17-12-8-9-13-19(17)5/h6-12,14H,13H2,1-5H3.
What are the key properties of 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine?
6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine has a molecular weight of 255.41 g/mol, XLogP of 4.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2,3-dimethylbutan-2-yl)phenyl]-1-methyl-2H-pyridine is sourced from PubChem (CID 143485899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).