N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine

C11H14N2OS — CID 613778

IUPACN-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOc1ccc(NC2=NCC(C)S2)cc1
InChIInChI=1S/C11H14N2OS/c1-8-7-12-11(15-8)13-9-3-5-10(14-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,12,13)
InChIKeyQKRSEPBFXYHLIO-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.60
Rot. Bonds2

About N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine

N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 613778) has the molecular formula C11H14N2OS and a molecular weight of 222.31 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID613778
Molecular FormulaC11H14N2OS
Molecular Weight222.31 g/mol
Exact Mass222.08
IUPAC NameN-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOc1ccc(NC2=NCC(C)S2)cc1
InChIInChI=1S/C11H14N2OS/c1-8-7-12-11(15-8)13-9-3-5-10(14-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,12,13)
InChIKeyQKRSEPBFXYHLIO-UHFFFAOYSA-N
XLogP2.60
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-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

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (CID 613778) is N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is COc1ccc(NC2=NCC(C)S2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is QKRSEPBFXYHLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2OS/c1-8-7-12-11(15-8)13-9-3-5-10(14-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,12,13).
What are the key properties of N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 222.31 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 613778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).