2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one

C8H11N3O — CID 139516327

IUPAC2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one
SMILESCCc1nc2c([nH]1)CCNC2=O
InChIInChI=1S/C8H11N3O/c1-2-6-10-5-3-4-9-8(12)7(5)11-6/h2-4H2,1H3,(H,9,12)(H,10,11)
InChIKeyTVPFPCQKIPPDLT-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.26
Rot. Bonds1

About 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one

2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one (PubChem CID 139516327) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one
PubChem CID139516327
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one
SMILESCCc1nc2c([nH]1)CCNC2=O
InChIInChI=1S/C8H11N3O/c1-2-6-10-5-3-4-9-8(12)7(5)11-6/h2-4H2,1H3,(H,9,12)(H,10,11)
InChIKeyTVPFPCQKIPPDLT-UHFFFAOYSA-N
XLogP0.26
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one?
The IUPAC name of 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one (CID 139516327) is 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one is CCc1nc2c([nH]1)CCNC2=O.
What is the InChIKey of 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one?
The InChIKey is TVPFPCQKIPPDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-2-6-10-5-3-4-9-8(12)7(5)11-6/h2-4H2,1H3,(H,9,12)(H,10,11).
What are the key properties of 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one?
2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one has a molecular weight of 165.20 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 139516327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).