1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one

C16H13F3N4O — CID 90381743

IUPAC1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one
SMILESCc1cc(C(F)(F)F)c2ccc3nc(N4CCCC4=O)cn3c2n1
InChIInChI=1S/C16H13F3N4O/c1-9-7-11(16(17,18)19)10-4-5-12-21-13(8-23(12)15(10)20-9)22-6-2-3-14(22)24/h4-5,7-8H,2-3,6H2,1H3
InChIKeyILWQSNGHTRFPND-UHFFFAOYSA-N
MW334.30 g/mol
LogP3.34
Rot. Bonds1

About 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one

1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one (PubChem CID 90381743) has the molecular formula C16H13F3N4O and a molecular weight of 334.30 g/mol. Its IUPAC name is 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one
PubChem CID90381743
Molecular FormulaC16H13F3N4O
Molecular Weight334.30 g/mol
Exact Mass334.10
IUPAC Name1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one
SMILESCc1cc(C(F)(F)F)c2ccc3nc(N4CCCC4=O)cn3c2n1
InChIInChI=1S/C16H13F3N4O/c1-9-7-11(16(17,18)19)10-4-5-12-21-13(8-23(12)15(10)20-9)22-6-2-3-14(22)24/h4-5,7-8H,2-3,6H2,1H3
InChIKeyILWQSNGHTRFPND-UHFFFAOYSA-N
XLogP3.34
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.30
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one?
The IUPAC name of 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one (CID 90381743) is 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one is Cc1cc(C(F)(F)F)c2ccc3nc(N4CCCC4=O)cn3c2n1.
What is the InChIKey of 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one?
The InChIKey is ILWQSNGHTRFPND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F3N4O/c1-9-7-11(16(17,18)19)10-4-5-12-21-13(8-23(12)15(10)20-9)22-6-2-3-14(22)24/h4-5,7-8H,2-3,6H2,1H3.
What are the key properties of 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one?
1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one has a molecular weight of 334.30 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methyl-4-(trifluoromethyl)imidazo[1,2-a][1,8]naphthyridin-8-yl]pyrrolidin-2-one is sourced from PubChem (CID 90381743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).