5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine

C12H18N2S2 — CID 115361150

IUPAC5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine
SMILESCC1(C)CN=C(NCCc2cccs2)SC1
InChIInChI=1S/C12H18N2S2/c1-12(2)8-14-11(16-9-12)13-6-5-10-4-3-7-15-10/h3-4,7H,5-6,8-9H2,1-2H3,(H,13,14)
InChIKeyJUYNEGGWLQVVJX-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.01
Rot. Bonds3

About 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine

5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine (PubChem CID 115361150) has the molecular formula C12H18N2S2 and a molecular weight of 254.42 g/mol. Its IUPAC name is 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine.

Molecular Properties

Compound Name5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine
PubChem CID115361150
Molecular FormulaC12H18N2S2
Molecular Weight254.42 g/mol
Exact Mass254.09
IUPAC Name5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine
SMILESCC1(C)CN=C(NCCc2cccs2)SC1
InChIInChI=1S/C12H18N2S2/c1-12(2)8-14-11(16-9-12)13-6-5-10-4-3-7-15-10/h3-4,7H,5-6,8-9H2,1-2H3,(H,13,14)
InChIKeyJUYNEGGWLQVVJX-UHFFFAOYSA-N
XLogP3.01
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine 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

N-[2-(5-chlorothiophen-2-yl)ethyl]-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 114140703
5,5-dimethyl-N-(2-methylsulfanylethyl)-4,6-dihydro-1,3-thiazin-2-amine
CID 115361656
N-(2-cyclopropylethyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115361732
N-[(3-bromophenyl)methyl]-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 113294190
3,5-dimethyl-N-(2-thiophen-2-ylethyl)aniline
CID 63774162
5,5-dimethyl-N-(3-pyrrolidin-1-ylpropyl)-4,6-dihydro-1,3-thiazin-2-amine
CID 113294282
3,4-dimethyl-N-(2-thiophen-2-ylethyl)aniline
CID 63773614
6-N-(2-thiophen-2-ylethyl)-2,3-dihydro-1,4-benzodioxine-6,7-diamine
CID 28904330
N-(2-chlorophenyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115361144
6-N-propyl-4-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80778240
N-(2-thiophen-2-ylethyl)-1,3-thiazol-2-amine
CID 29276059
N-(2-thiophen-2-ylethyl)-1,4,5,6-tetrahydropyrimidin-2-amine
CID 51105474

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine?
The IUPAC name of 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine (CID 115361150) is 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine.
What is the SMILES notation for 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine?
The canonical SMILES for 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine is CC1(C)CN=C(NCCc2cccs2)SC1.
What is the InChIKey of 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine?
The InChIKey is JUYNEGGWLQVVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2S2/c1-12(2)8-14-11(16-9-12)13-6-5-10-4-3-7-15-10/h3-4,7H,5-6,8-9H2,1-2H3,(H,13,14).
What are the key properties of 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine?
5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine has a molecular weight of 254.42 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-N-(2-thiophen-2-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine is sourced from PubChem (CID 115361150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).