2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine

C15H13ClN4S — CID 107125311

IUPAC2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine
SMILESCCNc1cc(-c2ccccc2)nc(-c2ncc(Cl)s2)n1
InChIInChI=1S/C15H13ClN4S/c1-2-17-13-8-11(10-6-4-3-5-7-10)19-14(20-13)15-18-9-12(16)21-15/h3-9H,2H2,1H3,(H,17,19,20)
InChIKeyZFVSJCRQDYHFHF-UHFFFAOYSA-N
MW316.82 g/mol
LogP4.35
Rot. Bonds4

About 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine

2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine (PubChem CID 107125311) has the molecular formula C15H13ClN4S and a molecular weight of 316.82 g/mol. Its IUPAC name is 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine
PubChem CID107125311
Molecular FormulaC15H13ClN4S
Molecular Weight316.82 g/mol
Exact Mass316.05
IUPAC Name2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine
SMILESCCNc1cc(-c2ccccc2)nc(-c2ncc(Cl)s2)n1
InChIInChI=1S/C15H13ClN4S/c1-2-17-13-8-11(10-6-4-3-5-7-10)19-14(20-13)15-18-9-12(16)21-15/h3-9H,2H2,1H3,(H,17,19,20)
InChIKeyZFVSJCRQDYHFHF-UHFFFAOYSA-N
XLogP4.35
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.82
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-chloro-1,3-thiazol-2-yl)-N-methyl-6-phenylpyrimidin-4-amine
CID 107125310
2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 107125410
N-ethyl-6-phenyl-2-pyrimidin-4-ylpyrimidin-4-amine
CID 63984866
2-(5-chloro-1,3-thiazol-2-yl)-N-methyl-6-propylpyrimidin-4-amine
CID 107125280
6-(3-chlorothiophen-2-yl)-N-ethyl-2-phenylpyrimidin-4-amine
CID 107361110
N-ethyl-2-phenyl-6-pyrazin-2-ylpyrimidin-4-amine
CID 115915110
2-(5-chloro-1,3-thiazol-2-yl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
CID 107125389
4-N-ethyl-2-N,2-N-dimethyl-6-phenylpyrimidine-2,4-diamine
CID 55045579
N-ethyl-2-(2-methylpyrazol-3-yl)-6-phenylpyrimidin-4-amine
CID 114554308
2-N,2-N,4-N-triethyl-6-phenylpyrimidine-2,4-diamine
CID 63485028
[2-(5-chloro-1,3-thiazol-2-yl)-5-methyl-6-phenylpyrimidin-4-yl]hydrazine
CID 107125450
4-N-ethyl-2-phenylpyrimidine-4,6-diamine
CID 112559773

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine?
The IUPAC name of 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine (CID 107125311) is 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine.
What is the SMILES notation for 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine?
The canonical SMILES for 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine is CCNc1cc(-c2ccccc2)nc(-c2ncc(Cl)s2)n1.
What is the InChIKey of 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine?
The InChIKey is ZFVSJCRQDYHFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN4S/c1-2-17-13-8-11(10-6-4-3-5-7-10)19-14(20-13)15-18-9-12(16)21-15/h3-9H,2H2,1H3,(H,17,19,20).
What are the key properties of 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine?
2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine has a molecular weight of 316.82 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-phenylpyrimidin-4-amine is sourced from PubChem (CID 107125311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).