N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide

C7H12N2OS — CID 118973566

IUPACN,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide
SMILESCNC(=O)C1CCSC(C)=N1
InChIInChI=1S/C7H12N2OS/c1-5-9-6(3-4-11-5)7(10)8-2/h6H,3-4H2,1-2H3,(H,8,10)
InChIKeyHPKHJEUPLIVWSN-UHFFFAOYSA-N
MW172.25 g/mol
LogP0.66
Rot. Bonds1

About N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide

N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide (PubChem CID 118973566) has the molecular formula C7H12N2OS and a molecular weight of 172.25 g/mol. Its IUPAC name is N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide
PubChem CID118973566
Molecular FormulaC7H12N2OS
Molecular Weight172.25 g/mol
Exact Mass172.07
IUPAC NameN,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide
SMILESCNC(=O)C1CCSC(C)=N1
InChIInChI=1S/C7H12N2OS/c1-5-9-6(3-4-11-5)7(10)8-2/h6H,3-4H2,1-2H3,(H,8,10)
InChIKeyHPKHJEUPLIVWSN-UHFFFAOYSA-N
XLogP0.66
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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ethane;methyl (4S)-2-benzyl-5,6-dihydro-4H-1,3-thiazine-4-carboxylate
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CID 89404179
CID 89404179
4-N-methylcyclohexane-1,4-dicarboxamide
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N-methyl-5-oxothiolane-3-carboxamide
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2-[(4-tert-butyl-5,6-dihydro-4H-1,3-thiazin-2-yl)amino]-N-methylpropanamide
CID 114177179
N,4-dimethylcyclohexane-1-carboxamide;ethane;methanamine
CID 145422265
1-(4-hydroxy-6-methyl-4,5-dihydropyrimidin-2-yl)-3-methylurea
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cis-(1R,2S)-2-acetyl-N-methylcyclopropane-1-carboxamide
CID 89112285
N-methyl-3,4-dihydro-1H-isothiochromene-1-carboxamide
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CID 58330084

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide?
The IUPAC name of N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide (CID 118973566) is N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide.
What is the SMILES notation for N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide?
The canonical SMILES for N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide is CNC(=O)C1CCSC(C)=N1.
What is the InChIKey of N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide?
The InChIKey is HPKHJEUPLIVWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2OS/c1-5-9-6(3-4-11-5)7(10)8-2/h6H,3-4H2,1-2H3,(H,8,10).
What are the key properties of N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide?
N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide has a molecular weight of 172.25 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5,6-dihydro-4H-1,3-thiazine-4-carboxamide is sourced from PubChem (CID 118973566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).