1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one

C18H23N5O3 — CID 72937482

IUPAC1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one
SMILESCCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C)no1)CC2
InChIInChI=1S/C18H23N5O3/c1-3-15(24)23-7-4-13-16(20-11-19-13)18(23)5-8-22(9-6-18)17(25)14-10-12(2)21-26-14/h10-11H,3-9H2,1-2H3,(H,19,20)
InChIKeyOVKPQSCAFRQATJ-UHFFFAOYSA-N
MW357.41 g/mol
LogP1.63
Rot. Bonds2

About 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one

1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one (PubChem CID 72937482) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one.

Molecular Properties

Compound Name1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one
PubChem CID72937482
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one
SMILESCCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C)no1)CC2
InChIInChI=1S/C18H23N5O3/c1-3-15(24)23-7-4-13-16(20-11-19-13)18(23)5-8-22(9-6-18)17(25)14-10-12(2)21-26-14/h10-11H,3-9H2,1-2H3,(H,19,20)
InChIKeyOVKPQSCAFRQATJ-UHFFFAOYSA-N
XLogP1.63
TPSA95.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-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-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one?
The IUPAC name of 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one (CID 72937482) is 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one.
What is the SMILES notation for 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one?
The canonical SMILES for 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one is CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C)no1)CC2.
What is the InChIKey of 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one?
The InChIKey is OVKPQSCAFRQATJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-3-15(24)23-7-4-13-16(20-11-19-13)18(23)5-8-22(9-6-18)17(25)14-10-12(2)21-26-14/h10-11H,3-9H2,1-2H3,(H,19,20).
What are the key properties of 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one?
1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one has a molecular weight of 357.41 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one is sourced from PubChem (CID 72937482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).