1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one

C20H25N5O2 — CID 67382111

IUPAC1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one
SMILESCCOCc1nc2cnc3cc(N4CCCC4=O)cnc3c2n1CC(C)C
InChIInChI=1S/C20H25N5O2/c1-4-27-12-17-23-16-10-21-15-8-14(24-7-5-6-18(24)26)9-22-19(15)20(16)25(17)11-13(2)3/h8-10,13H,4-7,11-12H2,1-3H3
InChIKeyMUJQGRPETBESDD-UHFFFAOYSA-N
MW367.45 g/mol
LogP3.30
Rot. Bonds6

About 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one

1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one (PubChem CID 67382111) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one
PubChem CID67382111
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one
SMILESCCOCc1nc2cnc3cc(N4CCCC4=O)cnc3c2n1CC(C)C
InChIInChI=1S/C20H25N5O2/c1-4-27-12-17-23-16-10-21-15-8-14(24-7-5-6-18(24)26)9-22-19(15)20(16)25(17)11-13(2)3/h8-10,13H,4-7,11-12H2,1-3H3
InChIKeyMUJQGRPETBESDD-UHFFFAOYSA-N
XLogP3.30
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one?
The IUPAC name of 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one (CID 67382111) is 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one is CCOCc1nc2cnc3cc(N4CCCC4=O)cnc3c2n1CC(C)C.
What is the InChIKey of 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one?
The InChIKey is MUJQGRPETBESDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-4-27-12-17-23-16-10-21-15-8-14(24-7-5-6-18(24)26)9-22-19(15)20(16)25(17)11-13(2)3/h8-10,13H,4-7,11-12H2,1-3H3.
What are the key properties of 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one?
1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one has a molecular weight of 367.45 g/mol, XLogP of 3.30, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c][1,5]naphthyridin-7-yl]pyrrolidin-2-one is sourced from PubChem (CID 67382111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).