7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one

C6H4BrN3O — CID 2305317

IUPAC7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one
SMILESO=c1[nH]cc(Br)c2nc[nH]c12
InChIInChI=1S/C6H4BrN3O/c7-3-1-8-6(11)5-4(3)9-2-10-5/h1-2H,(H,8,11)(H,9,10)
InChIKeyZYZOSWDYDRRXPZ-UHFFFAOYSA-N
MW214.02 g/mol
LogP1.01
Rot. Bonds

About 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one

7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one (PubChem CID 2305317) has the molecular formula C6H4BrN3O and a molecular weight of 214.02 g/mol. Its IUPAC name is 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one
PubChem CID2305317
Molecular FormulaC6H4BrN3O
Molecular Weight214.02 g/mol
Exact Mass212.95
IUPAC Name7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one
SMILESO=c1[nH]cc(Br)c2nc[nH]c12
InChIInChI=1S/C6H4BrN3O/c7-3-1-8-6(11)5-4(3)9-2-10-5/h1-2H,(H,8,11)(H,9,10)
InChIKeyZYZOSWDYDRRXPZ-UHFFFAOYSA-N
XLogP1.01
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.02
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one?
The IUPAC name of 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one (CID 2305317) is 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one is O=c1[nH]cc(Br)c2nc[nH]c12.
What is the InChIKey of 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one?
The InChIKey is ZYZOSWDYDRRXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrN3O/c7-3-1-8-6(11)5-4(3)9-2-10-5/h1-2H,(H,8,11)(H,9,10).
What are the key properties of 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one?
7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one has a molecular weight of 214.02 g/mol, XLogP of 1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3,5-dihydroimidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 2305317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).