3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C15H26N2 — CID 90336566

IUPAC3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1ncc2n1CC(C(C)(C)C)CC2
InChIInChI=1S/C15H26N2/c1-14(2,3)11-7-8-12-9-16-13(15(4,5)6)17(12)10-11/h9,11H,7-8,10H2,1-6H3
InChIKeyCEQJDNYNPYPWGC-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.79
Rot. Bonds

About 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 90336566) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID90336566
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1ncc2n1CC(C(C)(C)C)CC2
InChIInChI=1S/C15H26N2/c1-14(2,3)11-7-8-12-9-16-13(15(4,5)6)17(12)10-11/h9,11H,7-8,10H2,1-6H3
InChIKeyCEQJDNYNPYPWGC-UHFFFAOYSA-N
XLogP3.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 90336566) is 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC(C)(C)c1ncc2n1CC(C(C)(C)C)CC2.
What is the InChIKey of 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is CEQJDNYNPYPWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-14(2,3)11-7-8-12-9-16-13(15(4,5)6)17(12)10-11/h9,11H,7-8,10H2,1-6H3.
What are the key properties of 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 234.39 g/mol, XLogP of 3.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-ditert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 90336566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).