2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine

C11H19N3 — CID 117167016

IUPAC2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
SMILESCC(C)(C)Cc1nc2c([nH]1)CNCC2
InChIInChI=1S/C11H19N3/c1-11(2,3)6-10-13-8-4-5-12-7-9(8)14-10/h12H,4-7H2,1-3H3,(H,13,14)
InChIKeyIITFYJIWIMORMV-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.64
Rot. Bonds1

About 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine

2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine (PubChem CID 117167016) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
PubChem CID117167016
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
SMILESCC(C)(C)Cc1nc2c([nH]1)CNCC2
InChIInChI=1S/C11H19N3/c1-11(2,3)6-10-13-8-4-5-12-7-9(8)14-10/h12H,4-7H2,1-3H3,(H,13,14)
InChIKeyIITFYJIWIMORMV-UHFFFAOYSA-N
XLogP1.64
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine (CID 117167016) is 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine is CC(C)(C)Cc1nc2c([nH]1)CNCC2.
What is the InChIKey of 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine?
The InChIKey is IITFYJIWIMORMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-11(2,3)6-10-13-8-4-5-12-7-9(8)14-10/h12H,4-7H2,1-3H3,(H,13,14).
What are the key properties of 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine?
2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine has a molecular weight of 193.29 g/mol, XLogP of 1.64, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 117167016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).