(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid

C13H15N3O5 — CID 118599026

IUPAC(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid
SMILESCc1cc(NC(=O)O)c(=O)n2c1C(=O)NC21CCOCC1
InChIInChI=1S/C13H15N3O5/c1-7-6-8(14-12(19)20)11(18)16-9(7)10(17)15-13(16)2-4-21-5-3-13/h6,14H,2-5H2,1H3,(H,15,17)(H,19,20)
InChIKeyYVGVCPSQWOLVAM-UHFFFAOYSA-N
MW293.28 g/mol
LogP0.45
Rot. Bonds1

About (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid

(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid (PubChem CID 118599026) has the molecular formula C13H15N3O5 and a molecular weight of 293.28 g/mol. Its IUPAC name is (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid.

Molecular Properties

Compound Name(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid
PubChem CID118599026
Molecular FormulaC13H15N3O5
Molecular Weight293.28 g/mol
Exact Mass293.10
IUPAC Name(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid
SMILESCc1cc(NC(=O)O)c(=O)n2c1C(=O)NC21CCOCC1
InChIInChI=1S/C13H15N3O5/c1-7-6-8(14-12(19)20)11(18)16-9(7)10(17)15-13(16)2-4-21-5-3-13/h6,14H,2-5H2,1H3,(H,15,17)(H,19,20)
InChIKeyYVGVCPSQWOLVAM-UHFFFAOYSA-N
XLogP0.45
TPSA109.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.28
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid with MolForge

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

Launch Full Analysis

Related Compounds

6-amino-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione;hydrochloride
CID 118598681
6-amino-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 118598682
6-bromo-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 118598873
tert-butyl N-(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamate
CID 118604480
6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 118613740
tert-butyl-(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid
CID 139367390
8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 150104789
6-iodo-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 166877665
(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl) carbamate
CID 175306239
2'-bromo-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 175793055

Frequently Asked Questions

What is the IUPAC name of (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid?
The IUPAC name of (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid (CID 118599026) is (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid.
What is the SMILES notation for (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid?
The canonical SMILES for (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid is Cc1cc(NC(=O)O)c(=O)n2c1C(=O)NC21CCOCC1.
What is the InChIKey of (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid?
The InChIKey is YVGVCPSQWOLVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O5/c1-7-6-8(14-12(19)20)11(18)16-9(7)10(17)15-13(16)2-4-21-5-3-13/h6,14H,2-5H2,1H3,(H,15,17)(H,19,20).
What are the key properties of (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid?
(8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid has a molecular weight of 293.28 g/mol, XLogP of 0.45, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-6-yl)carbamic acid is sourced from PubChem (CID 118599026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).