N-ethyl-4-phenyl-1,3-thiazol-2-amine

C11H12N2S — CID 697115

IUPACN-ethyl-4-phenyl-1,3-thiazol-2-amine
SMILESCCNc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H12N2S/c1-2-12-11-13-10(8-14-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13)
InChIKeyGBPDSPQBKICWRK-UHFFFAOYSA-N
MW204.30 g/mol
LogP3.24
Rot. Bonds3

About N-ethyl-4-phenyl-1,3-thiazol-2-amine

N-ethyl-4-phenyl-1,3-thiazol-2-amine (PubChem CID 697115) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is N-ethyl-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-phenyl-1,3-thiazol-2-amine
PubChem CID697115
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC NameN-ethyl-4-phenyl-1,3-thiazol-2-amine
SMILESCCNc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H12N2S/c1-2-12-11-13-10(8-14-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13)
InChIKeyGBPDSPQBKICWRK-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Phenyl-N-(2-phenylethyl)-2-thiazolamine
CID 54339
2-Amino-4-phenylthiazole
CID 40302
2-Amino-4-phenyl-5-methylthiazole
CID 96129
2-Amino-4-(4-biphenylyl)thiazole
CID 76075
4-(4-Ethylphenyl)-5-methyl-1,3-thiazol-2-amine
CID 854786
2-Amino-4-phenylthiazole hydrobromide monohydrate
CID 40301
4-(2-Methylphenyl)-1,3-thiazol-2-amine
CID 220174
4-(4-Methylphenyl)-1,3-thiazol-2(3H)-imine
CID 244066
5-Methyl-4-(4-methylphenyl)-1,3-thiazol-2-amine
CID 702265
N-cyclohexyl-4-phenyl-1,3-thiazol-2-amine
CID 2447522
2-Hydrazinyl-4-phenylthiazole
CID 98613
2-Thiazolamine, 5-ethyl-4-phenyl-
CID 147560

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-phenyl-1,3-thiazol-2-amine (CID 697115) is N-ethyl-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-phenyl-1,3-thiazol-2-amine is CCNc1nc(-c2ccccc2)cs1.
What is the InChIKey of N-ethyl-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is GBPDSPQBKICWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-2-12-11-13-10(8-14-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,12,13).
What are the key properties of N-ethyl-4-phenyl-1,3-thiazol-2-amine?
N-ethyl-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 204.30 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 697115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).