1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide

C15H20N2O3S — CID 72901634

IUPAC1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)N1CCS(=O)(=O)CC1
InChIInChI=1S/C15H20N2O3S/c18-15(17-8-10-21(19,20)11-9-17)16-14-7-3-5-12-4-1-2-6-13(12)14/h3,5,7H,1-2,4,6,8-11H2,(H,16,18)
InChIKeyFVDWKHRVBFRQAU-UHFFFAOYSA-N
MW308.40 g/mol
LogP1.83
Rot. Bonds1

About 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide

1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide (PubChem CID 72901634) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide.

Molecular Properties

Compound Name1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide
PubChem CID72901634
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC Name1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)N1CCS(=O)(=O)CC1
InChIInChI=1S/C15H20N2O3S/c18-15(17-8-10-21(19,20)11-9-17)16-14-7-3-5-12-4-1-2-6-13(12)14/h3,5,7H,1-2,4,6,8-11H2,(H,16,18)
InChIKeyFVDWKHRVBFRQAU-UHFFFAOYSA-N
XLogP1.83
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide 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

1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-naphthalen-2-ylurea
CID 3152358
1-(1,1-Dioxidotetrahydrothiophen-3-yl)-1-(2-hydroxyethyl)-3-(naphthalen-1-yl)urea
CID 2906369
N-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)-3-phenylpropane-1-sulfonamide
CID 168288911
1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea
CID 2897256
1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea
CID 3146698
1-[[2-[(Ethenylsulfonylamino)methyl]phenyl]methyl]-1-(1-pentan-2-ylpiperidin-4-yl)-3-[3-(trifluoromethyl)phenyl]urea
CID 126711691
3-{[(benzylsulfonyl)amino]methyl}-N-phenylpiperidine-1-carboxamide
CID 16189557
N-[3-(1,1-dioxo-1,4-thiazinan-4-yl)phenyl]-4-phenylpiperidine-1-carboxamide
CID 118679493
2-Ethyl-N-(1-naphthyl)-1-piperidinecarboxamide
CID 6467474
3-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 4090860
N-(3-methylphenyl)-4-(propylsulfonylamino)piperidine-1-carboxamide
CID 40149608
1-(2,6-Difluorophenyl)-3-(2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)urea
CID 45504841

Frequently Asked Questions

What is the IUPAC name of 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide?
The IUPAC name of 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide (CID 72901634) is 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide.
What is the SMILES notation for 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide?
The canonical SMILES for 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide is O=C(Nc1cccc2c1CCCC2)N1CCS(=O)(=O)CC1.
What is the InChIKey of 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide?
The InChIKey is FVDWKHRVBFRQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c18-15(17-8-10-21(19,20)11-9-17)16-14-7-3-5-12-4-1-2-6-13(12)14/h3,5,7H,1-2,4,6,8-11H2,(H,16,18).
What are the key properties of 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide?
1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide has a molecular weight of 308.40 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dioxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,4-thiazinane-4-carboxamide is sourced from PubChem (CID 72901634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).