(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine

C11H14N2S — CID 70300206

IUPAC(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1ccc(C2SC(N)=N[C@@H]2C)cc1
InChIInChI=1S/C11H14N2S/c1-7-3-5-9(6-4-7)10-8(2)13-11(12)14-10/h3-6,8,10H,1-2H3,(H2,12,13)/t8-,10?/m1/s1
InChIKeyKWWTWICEMDMPRG-HNHGDDPOSA-N
MW206.31 g/mol
LogP2.49
Rot. Bonds1

About (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine

(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 70300206) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID70300206
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1ccc(C2SC(N)=N[C@@H]2C)cc1
InChIInChI=1S/C11H14N2S/c1-7-3-5-9(6-4-7)10-8(2)13-11(12)14-10/h3-6,8,10H,1-2H3,(H2,12,13)/t8-,10?/m1/s1
InChIKeyKWWTWICEMDMPRG-HNHGDDPOSA-N
XLogP2.49
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 70300206) is (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is Cc1ccc(C2SC(N)=N[C@@H]2C)cc1.
What is the InChIKey of (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is KWWTWICEMDMPRG-HNHGDDPOSA-N. The full InChI is InChI=1S/C11H14N2S/c1-7-3-5-9(6-4-7)10-8(2)13-11(12)14-10/h3-6,8,10H,1-2H3,(H2,12,13)/t8-,10?/m1/s1.
What are the key properties of (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
(4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 206.31 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-5-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 70300206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).