6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine

C10H15N3 — CID 138655061

IUPAC6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine
SMILESCC(C)(C)c1cc2c(cn1)NCN2
InChIInChI=1S/C10H15N3/c1-10(2,3)9-4-7-8(5-11-9)13-6-12-7/h4-5,12-13H,6H2,1-3H3
InChIKeyTWHUJSYBTBBQAJ-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.17
Rot. Bonds

About 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine

6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine (PubChem CID 138655061) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine
PubChem CID138655061
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine
SMILESCC(C)(C)c1cc2c(cn1)NCN2
InChIInChI=1S/C10H15N3/c1-10(2,3)9-4-7-8(5-11-9)13-6-12-7/h4-5,12-13H,6H2,1-3H3
InChIKeyTWHUJSYBTBBQAJ-UHFFFAOYSA-N
XLogP2.17
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine (CID 138655061) is 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine is CC(C)(C)c1cc2c(cn1)NCN2.
What is the InChIKey of 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The InChIKey is TWHUJSYBTBBQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-10(2,3)9-4-7-8(5-11-9)13-6-12-7/h4-5,12-13H,6H2,1-3H3.
What are the key properties of 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine has a molecular weight of 177.25 g/mol, XLogP of 2.17, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2,3-dihydro-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 138655061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).