6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one

C8H10N4O — CID 18683078

IUPAC6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one
SMILESCCn1cnc2c(=O)[nH]c(N)cc21
InChIInChI=1S/C8H10N4O/c1-2-12-4-10-7-5(12)3-6(9)11-8(7)13/h3-4H,2H2,1H3,(H3,9,11,13)
InChIKeyKPBLFDNMVWLFSC-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.33
Rot. Bonds1

About 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one

6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one (PubChem CID 18683078) has the molecular formula C8H10N4O and a molecular weight of 178.19 g/mol. Its IUPAC name is 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one
PubChem CID18683078
Molecular FormulaC8H10N4O
Molecular Weight178.19 g/mol
Exact Mass178.09
IUPAC Name6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one
SMILESCCn1cnc2c(=O)[nH]c(N)cc21
InChIInChI=1S/C8H10N4O/c1-2-12-4-10-7-5(12)3-6(9)11-8(7)13/h3-4H,2H2,1H3,(H3,9,11,13)
InChIKeyKPBLFDNMVWLFSC-UHFFFAOYSA-N
XLogP0.33
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one?
The IUPAC name of 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one (CID 18683078) is 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one is CCn1cnc2c(=O)[nH]c(N)cc21.
What is the InChIKey of 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one?
The InChIKey is KPBLFDNMVWLFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c1-2-12-4-10-7-5(12)3-6(9)11-8(7)13/h3-4H,2H2,1H3,(H3,9,11,13).
What are the key properties of 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one?
6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one has a molecular weight of 178.19 g/mol, XLogP of 0.33, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-ethyl-5H-imidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 18683078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).