3-tert-butyl-3-methyl-2H-pyridine

C10H17N — CID 146243823

IUPAC3-tert-butyl-3-methyl-2H-pyridine
SMILESCC(C)(C)C1(C)C=CC=NC1
InChIInChI=1S/C10H17N/c1-9(2,3)10(4)6-5-7-11-8-10/h5-7H,8H2,1-4H3
InChIKeySMNOLZTUBKVDLR-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.68
Rot. Bonds

About 3-tert-butyl-3-methyl-2H-pyridine

3-tert-butyl-3-methyl-2H-pyridine (PubChem CID 146243823) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3-tert-butyl-3-methyl-2H-pyridine.

Molecular Properties

Compound Name3-tert-butyl-3-methyl-2H-pyridine
PubChem CID146243823
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3-tert-butyl-3-methyl-2H-pyridine
SMILESCC(C)(C)C1(C)C=CC=NC1
InChIInChI=1S/C10H17N/c1-9(2,3)10(4)6-5-7-11-8-10/h5-7H,8H2,1-4H3
InChIKeySMNOLZTUBKVDLR-UHFFFAOYSA-N
XLogP2.68
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-3-methyl-2H-pyridine?
The IUPAC name of 3-tert-butyl-3-methyl-2H-pyridine (CID 146243823) is 3-tert-butyl-3-methyl-2H-pyridine.
What is the SMILES notation for 3-tert-butyl-3-methyl-2H-pyridine?
The canonical SMILES for 3-tert-butyl-3-methyl-2H-pyridine is CC(C)(C)C1(C)C=CC=NC1.
What is the InChIKey of 3-tert-butyl-3-methyl-2H-pyridine?
The InChIKey is SMNOLZTUBKVDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2,3)10(4)6-5-7-11-8-10/h5-7H,8H2,1-4H3.
What are the key properties of 3-tert-butyl-3-methyl-2H-pyridine?
3-tert-butyl-3-methyl-2H-pyridine has a molecular weight of 151.25 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-3-methyl-2H-pyridine is sourced from PubChem (CID 146243823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).