(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine

C13H16N2S — CID 164581205

IUPAC(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine
SMILESCc1ccc(/C(N)=C/n2sc(C)c2C)cc1
InChIInChI=1S/C13H16N2S/c1-9-4-6-12(7-5-9)13(14)8-15-10(2)11(3)16-15/h4-8H,14H2,1-3H3/b13-8-
InChIKeyNLTVBOZBUADMEW-JYRVWZFOSA-N
MW232.35 g/mol
LogP3.39
Rot. Bonds2

About (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine

(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine (PubChem CID 164581205) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine.

Molecular Properties

Compound Name(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine
PubChem CID164581205
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC Name(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine
SMILESCc1ccc(/C(N)=C/n2sc(C)c2C)cc1
InChIInChI=1S/C13H16N2S/c1-9-4-6-12(7-5-9)13(14)8-15-10(2)11(3)16-15/h4-8H,14H2,1-3H3/b13-8-
InChIKeyNLTVBOZBUADMEW-JYRVWZFOSA-N
XLogP3.39
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine 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

(Z)-1-(4-ethylphenyl)-2-(4-methylthiazet-2-yl)ethenamine
CID 164581237
S-[(Z)-2-amino-2-(4-methylphenyl)ethenyl]thiohydroxylamine;ethane
CID 142052900
(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine
CID 149258743
ethane;1-methyl-4-[3-(4-methylphenyl)but-2-en-2-yl]benzene
CID 91583110
1-(4-methylphenyl)prop-1-en-1-ol
CID 67275749
(Z)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 5376861
(E)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 21160961
ethyl (Z)-3-amino-3-(4-methylphenyl)prop-2-enoate
CID 12021527
1-[2-[2,2-bis(4-methylphenyl)ethenylsulfanyl]-1-(4-methylphenyl)ethenyl]-4-methylbenzene
CID 175983739
(3Z)-3-[(Z)-[(E)-3-amino-1-(4-chlorophenyl)-3-(4-methylphenyl)prop-2-enylidene]hydrazinylidene]-3-(4-chlorophenyl)-1-(4-methylphenyl)prop-1-en-1-amine
CID 134934129
(E)-2,3-bis(4-methylphenyl)but-2-enoic acid
CID 137447893
(Z)-2-(methylideneamino)-2-(4-methylphenyl)ethenethiol
CID 143018409

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine?
The IUPAC name of (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine (CID 164581205) is (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine.
What is the SMILES notation for (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine?
The canonical SMILES for (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine is Cc1ccc(/C(N)=C/n2sc(C)c2C)cc1.
What is the InChIKey of (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine?
The InChIKey is NLTVBOZBUADMEW-JYRVWZFOSA-N. The full InChI is InChI=1S/C13H16N2S/c1-9-4-6-12(7-5-9)13(14)8-15-10(2)11(3)16-15/h4-8H,14H2,1-3H3/b13-8-.
What are the key properties of (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine?
(Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine has a molecular weight of 232.35 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(3,4-dimethylthiazet-2-yl)-1-(4-methylphenyl)ethenamine is sourced from PubChem (CID 164581205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).