1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one

C20H25N5O3 — CID 72865518

IUPAC1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one
SMILESCCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(=O)n(C)c1)CC2
InChIInChI=1S/C20H25N5O3/c1-3-16(26)25-9-6-15-18(22-13-21-15)20(25)7-10-24(11-8-20)19(28)14-4-5-17(27)23(2)12-14/h4-5,12-13H,3,6-11H2,1-2H3,(H,21,22)
InChIKeyZTPBLCQARJEZBG-UHFFFAOYSA-N
MW383.45 g/mol
LogP1.03
Rot. Bonds2

About 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one

1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one (PubChem CID 72865518) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one
PubChem CID72865518
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC Name1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one
SMILESCCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(=O)n(C)c1)CC2
InChIInChI=1S/C20H25N5O3/c1-3-16(26)25-9-6-15-18(22-13-21-15)20(25)7-10-24(11-8-20)19(28)14-4-5-17(27)23(2)12-14/h4-5,12-13H,3,6-11H2,1-2H3,(H,21,22)
InChIKeyZTPBLCQARJEZBG-UHFFFAOYSA-N
XLogP1.03
TPSA91.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-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-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one?
The IUPAC name of 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one (CID 72865518) is 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one.
What is the SMILES notation for 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one?
The canonical SMILES for 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one is CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(=O)n(C)c1)CC2.
What is the InChIKey of 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one?
The InChIKey is ZTPBLCQARJEZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O3/c1-3-16(26)25-9-6-15-18(22-13-21-15)20(25)7-10-24(11-8-20)19(28)14-4-5-17(27)23(2)12-14/h4-5,12-13H,3,6-11H2,1-2H3,(H,21,22).
What are the key properties of 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one?
1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one has a molecular weight of 383.45 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one is sourced from PubChem (CID 72865518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).