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

C11H18N2 — CID 59825815

IUPAC1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1ncn2c1CCCC2
InChIInChI=1S/C11H18N2/c1-11(2,3)10-9-6-4-5-7-13(9)8-12-10/h8H,4-7H2,1-3H3
InChIKeyNGGATHZQJJUUCX-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.52
Rot. Bonds

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

1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 59825815) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID59825815
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)(C)c1ncn2c1CCCC2
InChIInChI=1S/C11H18N2/c1-11(2,3)10-9-6-4-5-7-13(9)8-12-10/h8H,4-7H2,1-3H3
InChIKeyNGGATHZQJJUUCX-UHFFFAOYSA-N
XLogP2.52
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 59825815) is 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC(C)(C)c1ncn2c1CCCC2.
What is the InChIKey of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is NGGATHZQJJUUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-11(2,3)10-9-6-4-5-7-13(9)8-12-10/h8H,4-7H2,1-3H3.
What are the key properties of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 178.28 g/mol, XLogP of 2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 59825815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).