3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one

C17H14N4O — CID 3071939

IUPAC3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
SMILESCCn1cnc2c3cccnc3n(-c3ccccc3)c(=O)c21
InChIInChI=1S/C17H14N4O/c1-2-20-11-19-14-13-9-6-10-18-16(13)21(17(22)15(14)20)12-7-4-3-5-8-12/h3-11H,2H2,1H3
InChIKeyIFOBHIRVXLLDIB-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.76
Rot. Bonds2

About 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one

3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one (PubChem CID 3071939) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one.

Molecular Properties

Compound Name3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
PubChem CID3071939
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
SMILESCCn1cnc2c3cccnc3n(-c3ccccc3)c(=O)c21
InChIInChI=1S/C17H14N4O/c1-2-20-11-19-14-13-9-6-10-18-16(13)21(17(22)15(14)20)12-7-4-3-5-8-12/h3-11H,2H2,1H3
InChIKeyIFOBHIRVXLLDIB-UHFFFAOYSA-N
XLogP2.76
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-butyl-1-methyl-
CID 3077017
KF 17625
CID 126487
KF 18280
CID 3071941
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 748028
1-Benzyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
CID 21604934
2-(4-Fluorophenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 712408
Pimefyllin
CID 65597
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-methyl-5-phenyl-
CID 3071959
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-5-phenyl-3-propyl-
CID 3071969
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(2-methylpropyl)-5-phenyl-
CID 3071971
1-benzyl-3-propyl-1H,3H-pyrido(2,1-f)purine-2,4-dione
CID 10359522
Imidazopyridine 18a
CID 5329351

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The IUPAC name of 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one (CID 3071939) is 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one.
What is the SMILES notation for 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The canonical SMILES for 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one is CCn1cnc2c3cccnc3n(-c3ccccc3)c(=O)c21.
What is the InChIKey of 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The InChIKey is IFOBHIRVXLLDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-2-20-11-19-14-13-9-6-10-18-16(13)21(17(22)15(14)20)12-7-4-3-5-8-12/h3-11H,2H2,1H3.
What are the key properties of 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one has a molecular weight of 290.33 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one is sourced from PubChem (CID 3071939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).