4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine

C13H10N4S — CID 767548

IUPAC4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine
SMILESc1ccc(-c2csc(Nc3ncccn3)n2)cc1
InChIInChI=1S/C13H10N4S/c1-2-5-10(6-3-1)11-9-18-13(16-11)17-12-14-7-4-8-15-12/h1-9H,(H,14,15,16,17)
InChIKeyFMLLSOIFCVZTFJ-UHFFFAOYSA-N
MW254.32 g/mol
LogP3.34
Rot. Bonds3

About 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine

4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine (PubChem CID 767548) has the molecular formula C13H10N4S and a molecular weight of 254.32 g/mol. Its IUPAC name is 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine
PubChem CID767548
Molecular FormulaC13H10N4S
Molecular Weight254.32 g/mol
Exact Mass254.06
IUPAC Name4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine
SMILESc1ccc(-c2csc(Nc3ncccn3)n2)cc1
InChIInChI=1S/C13H10N4S/c1-2-5-10(6-3-1)11-9-18-13(16-11)17-12-14-7-4-8-15-12/h1-9H,(H,14,15,16,17)
InChIKeyFMLLSOIFCVZTFJ-UHFFFAOYSA-N
XLogP3.34
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.32
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-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

Stf-62247
CID 704473
4-(2,4-Dimethyl-Thiazol-5-Yl)-Pyrimidin-2-Ylamine
CID 447956
Thiazovivin
CID 46209426
4-(2,4-Dimethyl-1,3-thiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]-2-pyrimidinamine
CID 447958
N-(4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-YL)-N',N'-dimethyl-benzene-1,4-diamine
CID 447962
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
Acetamide, N-[4-[2-(2-pyridinylamino)-4-thiazolyl]phenyl]-
CID 973066
4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzenesulfonamide
CID 3120504
N4-isobutyl-N2-((2-phenylthiazol-4-yl)methyl)pyrimidine-2,4-diamine
CID 71304818
4-(Pyridin-4-yl)-1,3-thiazol-2-amine
CID 930237
2-(1H-Imidazol-4-ylmethyl)-4-phenyl-thiazole
CID 14742545
N-(2-ethylphenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine
CID 746667

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine (CID 767548) is 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine is c1ccc(-c2csc(Nc3ncccn3)n2)cc1.
What is the InChIKey of 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The InChIKey is FMLLSOIFCVZTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4S/c1-2-5-10(6-3-1)11-9-18-13(16-11)17-12-14-7-4-8-15-12/h1-9H,(H,14,15,16,17).
What are the key properties of 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine has a molecular weight of 254.32 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-pyrimidin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 767548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).