N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine

C11H13N3S — CID 135052689

IUPACN,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine
SMILESCN(C)C1=NN=CC(c2ccccc2)S1
InChIInChI=1S/C11H13N3S/c1-14(2)11-13-12-8-10(15-11)9-6-4-3-5-7-9/h3-8,10H,1-2H3
InChIKeyHGXHMPUEKFNWBY-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.38
Rot. Bonds1

About N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine

N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine (PubChem CID 135052689) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine
PubChem CID135052689
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC NameN,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine
SMILESCN(C)C1=NN=CC(c2ccccc2)S1
InChIInChI=1S/C11H13N3S/c1-14(2)11-13-12-8-10(15-11)9-6-4-3-5-7-9/h3-8,10H,1-2H3
InChIKeyHGXHMPUEKFNWBY-UHFFFAOYSA-N
XLogP2.38
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Benzaldehyde 3-benzylisothiosemicarbazone
CID 9602279
5-phenyl-2-pyrrolidinyl-6H-1,3,4-thiadiazine
CID 15171029
5-benzyl-5H-1,3-thiazole-2-thione
CID 88803890
N,N-dimethyl-5,6-diphenyl-6H-1,3,4-thiadiazin-2-amine
CID 12332475
Phenylimidazo[2,1-b]thiazolium bromide
CID 129780589
Methoxy-6-phenyl-6h-1,3,4-thiadiazine
CID 129796599
benzaldehyde-S-benzylisothiosemicarbazone
CID 129835565
6-(4-chlorophenyl)-N,N-dimethyl-6H-1,3,4-thiadiazin-2-amine
CID 134890902
6-(4-bromophenyl)-N,N-dimethyl-6H-1,3,4-thiadiazin-2-amine
CID 135052694
Benzyl 2-phenylethylidene-hydrazinecarboximidothioate hydrochloride
CID 145944216
benzyl (NE)-N-(dimethylaminomethylidene)carbamodithioate
CID 13776690
benzyl (NE)-N-[1-(dimethylamino)ethylidene]carbamodithioate
CID 15099009

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine?
The IUPAC name of N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine (CID 135052689) is N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine.
What is the SMILES notation for N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine?
The canonical SMILES for N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine is CN(C)C1=NN=CC(c2ccccc2)S1.
What is the InChIKey of N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine?
The InChIKey is HGXHMPUEKFNWBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-14(2)11-13-12-8-10(15-11)9-6-4-3-5-7-9/h3-8,10H,1-2H3.
What are the key properties of N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine?
N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine has a molecular weight of 219.31 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-phenyl-6H-1,3,4-thiadiazin-2-amine is sourced from PubChem (CID 135052689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).