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

C11H14N2S — CID 2802273

IUPAC5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1ccccc1NC1=NCC(C)S1
InChIInChI=1S/C11H14N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h3-6,9H,7H2,1-2H3,(H,12,13)
InChIKeyNMDZRTMSJGRLJV-UHFFFAOYSA-N
MW206.31 g/mol
LogP2.90
Rot. Bonds1

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

5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 2802273) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID2802273
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1ccccc1NC1=NCC(C)S1
InChIInChI=1S/C11H14N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h3-6,9H,7H2,1-2H3,(H,12,13)
InChIKeyNMDZRTMSJGRLJV-UHFFFAOYSA-N
XLogP2.90
TPSA24.39 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 ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 2802273) is 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is Cc1ccccc1NC1=NCC(C)S1.
What is the InChIKey of 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is NMDZRTMSJGRLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-8-5-3-4-6-10(8)13-11-12-7-9(2)14-11/h3-6,9H,7H2,1-2H3,(H,12,13).
What are the key properties of 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 206.31 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 2802273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).