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

C22H16N4O — CID 3071941

IUPAC3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
SMILESO=c1c2c(ncn2Cc2ccccc2)c2cccnc2n1-c1ccccc1
InChIInChI=1S/C22H16N4O/c27-22-20-19(24-15-25(20)14-16-8-3-1-4-9-16)18-12-7-13-23-21(18)26(22)17-10-5-2-6-11-17/h1-13,15H,14H2
InChIKeyHNQGGXAGBKEMKM-UHFFFAOYSA-N
MW352.40 g/mol
LogP3.78
Rot. Bonds3

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

3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one (PubChem CID 3071941) has the molecular formula C22H16N4O and a molecular weight of 352.40 g/mol. Its IUPAC name is 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one.

Molecular Properties

Compound Name3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
PubChem CID3071941
Molecular FormulaC22H16N4O
Molecular Weight352.40 g/mol
Exact Mass352.13
IUPAC Name3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one
SMILESO=c1c2c(ncn2Cc2ccccc2)c2cccnc2n1-c1ccccc1
InChIInChI=1S/C22H16N4O/c27-22-20-19(24-15-25(20)14-16-8-3-1-4-9-16)18-12-7-13-23-21(18)26(22)17-10-5-2-6-11-17/h1-13,15H,14H2
InChIKeyHNQGGXAGBKEMKM-UHFFFAOYSA-N
XLogP3.78
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 53.78
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
2,2-Dimethyl-7-(2-Oxidanylidene-3~{h}-Imidazo[4,5-B]pyridin-1-Yl)-1-(Phenylmethyl)-3~{h}-Quinazolin-4-One
CID 118409668
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
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-ethyl-5-phenyl-
CID 3071939
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
6-Cyclopropyl-3-(pyrimidin-5-ylamino)-pyridine-2-carboxylic acid (2-phenyl-imidazo[1,2-a]pyrimidin-7-yl)-amide
CID 53468024

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The IUPAC name of 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one (CID 3071941) is 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one.
What is the SMILES notation for 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The canonical SMILES for 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one is O=c1c2c(ncn2Cc2ccccc2)c2cccnc2n1-c1ccccc1.
What is the InChIKey of 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
The InChIKey is HNQGGXAGBKEMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4O/c27-22-20-19(24-15-25(20)14-16-8-3-1-4-9-16)18-12-7-13-23-21(18)26(22)17-10-5-2-6-11-17/h1-13,15H,14H2.
What are the key properties of 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one?
3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one has a molecular weight of 352.40 g/mol, XLogP of 3.78, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-5-phenylimidazo[4,5-c][1,8]naphthyridin-4-one is sourced from PubChem (CID 3071941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).