N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine

C16H14N2S — CID 622356

IUPACN-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C16H14N2S/c1-12-7-9-14(10-8-12)17-16-18-15(11-19-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyXJMKZRVSZRZXQN-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.86
Rot. Bonds3

About N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine

N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine (PubChem CID 622356) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine
PubChem CID622356
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC NameN-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C16H14N2S/c1-12-7-9-14(10-8-12)17-16-18-15(11-19-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyXJMKZRVSZRZXQN-UHFFFAOYSA-N
XLogP4.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4,5-diphenylthiazole
CID 73222
2-Amino-4-phenylthiazole
CID 40302
2-Amino-4-phenyl-5-methylthiazole
CID 96129
4-Phenyl-N-(2-phenylethyl)-2-thiazolamine
CID 54339
Stf-62247
CID 704473
2-Amino-4-(4-biphenylyl)thiazole
CID 76075
2-Amino-4-phenylthiazole hydrobromide monohydrate
CID 40301
6-Ethyl-1,3-benzothiazol-2-amine
CID 773093
4-(2-Methylphenyl)-1,3-thiazol-2-amine
CID 220174
4-(4-Methylphenyl)-1,3-thiazol-2(3H)-imine
CID 244066
N-cyclohexyl-4-phenyl-1,3-thiazol-2-amine
CID 2447522
2-Thiazolamine, 5-ethyl-4-phenyl-
CID 147560

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine (CID 622356) is N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine is Cc1ccc(Nc2nc(-c3ccccc3)cs2)cc1.
What is the InChIKey of N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is XJMKZRVSZRZXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c1-12-7-9-14(10-8-12)17-16-18-15(11-19-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18).
What are the key properties of N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine?
N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 266.37 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 622356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).