8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one

C16H16ClNO3 — CID 90987997

IUPAC8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one
SMILESCON1CCC2(CC1)OC(=O)C1=C2Cc2cccc(Cl)c21
InChIInChI=1S/C16H16ClNO3/c1-20-18-7-5-16(6-8-18)11-9-10-3-2-4-12(17)13(10)14(11)15(19)21-16/h2-4H,5-9H2,1H3
InChIKeyYYVOOKBOMSIIRL-UHFFFAOYSA-N
MW305.76 g/mol
LogP2.60
Rot. Bonds1

About 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one

8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one (PubChem CID 90987997) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one.

Molecular Properties

Compound Name8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one
PubChem CID90987997
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC Name8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one
SMILESCON1CCC2(CC1)OC(=O)C1=C2Cc2cccc(Cl)c21
InChIInChI=1S/C16H16ClNO3/c1-20-18-7-5-16(6-8-18)11-9-10-3-2-4-12(17)13(10)14(11)15(19)21-16/h2-4H,5-9H2,1H3
InChIKeyYYVOOKBOMSIIRL-UHFFFAOYSA-N
XLogP2.60
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-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

Related Compounds

3-(2,4-dichloro-6-methylphenyl)-4-hydroxy-8-methoxy-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
CID 59584769
3-(3-bromo-2,6-dimethylphenyl)-4-hydroxy-8-methoxy-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
CID 66797651
[3-(2,4-dichlorophenyl)-8-methoxy-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-en-4-yl] ethyl carbonate
CID 66797755
ethyl [8-methoxy-2-oxo-3-(2,4,6-trimethylphenyl)-1-oxa-8-azaspiro[4.5]dec-3-en-4-yl] carbonate
CID 66793895
6-chloro-1'-methylspiro[2-benzofuran-3,4'-piperidine]-1-one
CID 67962414
3-(3,4-dichlorophenyl)-8-methoxy-1-oxa-8-azaspiro[4.5]decane-2,4-dione
CID 91417294
8-chloro-4H-isoquinoline-1,3-dione
CID 125180476
4-hydroxy-8-methoxy-3-[2-methyl-5-(trifluoromethyl)phenyl]-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
CID 67818814
ethyl [8-methoxy-2-oxo-3-[2,4,6-tri(propan-2-yl)phenyl]-1-oxa-8-azaspiro[4.5]dec-3-en-4-yl] carbonate
CID 66797774
ethyl [8-methoxy-3-(2-methoxy-4,6-dimethylphenyl)-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-en-4-yl] carbonate
CID 66797798
tert-butyl 7-chloro-3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-carboxylate
CID 58137248
[3-(2-cyclopropyl-4,6-dimethylphenyl)-8-methoxy-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-en-4-yl] ethyl carbonate
CID 66797681

Frequently Asked Questions

What is the IUPAC name of 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one?
The IUPAC name of 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one (CID 90987997) is 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one.
What is the SMILES notation for 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one?
The canonical SMILES for 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one is CON1CCC2(CC1)OC(=O)C1=C2Cc2cccc(Cl)c21.
What is the InChIKey of 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one?
The InChIKey is YYVOOKBOMSIIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-18-7-5-16(6-8-18)11-9-10-3-2-4-12(17)13(10)14(11)15(19)21-16/h2-4H,5-9H2,1H3.
What are the key properties of 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one?
8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one has a molecular weight of 305.76 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-1'-methoxyspiro[4H-indeno[1,2-c]furan-3,4'-piperidine]-1-one is sourced from PubChem (CID 90987997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).