N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine

C16H15N3S — CID 58910456

IUPACN-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCc1cc(C)cc(Nc2nc(-c3cccnc3)cs2)c1
InChIInChI=1S/C16H15N3S/c1-11-6-12(2)8-14(7-11)18-16-19-15(10-20-16)13-4-3-5-17-9-13/h3-10H,1-2H3,(H,18,19)
InChIKeyVQJWPJNIUQRXNJ-UHFFFAOYSA-N
MW281.38 g/mol
LogP4.57
Rot. Bonds3

About N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine

N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 58910456) has the molecular formula C16H15N3S and a molecular weight of 281.38 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID58910456
Molecular FormulaC16H15N3S
Molecular Weight281.38 g/mol
Exact Mass281.10
IUPAC NameN-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCc1cc(C)cc(Nc2nc(-c3cccnc3)cs2)c1
InChIInChI=1S/C16H15N3S/c1-11-6-12(2)8-14(7-11)18-16-19-15(10-20-16)13-4-3-5-17-9-13/h3-10H,1-2H3,(H,18,19)
InChIKeyVQJWPJNIUQRXNJ-UHFFFAOYSA-N
XLogP4.57
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-dipyridin-3-yl-1,3-thiazol-2-amine
CID 2215784
N-[4-(4-methylphenoxy)phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791876
4-N,4-N-dimethyl-1-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzene-1,4-diamine;hydrobromide
CID 5344942
3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzamide
CID 58791547
N-(6-phenyl-3-pyridinyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791761
N-[3-(difluoromethyl)-4-fluorophenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 143328866
N-tert-butyl-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 62942552
N-(3,5-dimethylphenyl)-6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 133462718
3-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-4-(trideuterio(113C)methyl)benzene-1,3-diamine
CID 91971706
1-(4-methylphenyl)-3-[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]urea
CID 10432011
N-(2-ethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 746667
4-methyl-3-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzene-1,3-diamine;1,3-thiazol-2-amine
CID 159379452

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine (CID 58910456) is N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine is Cc1cc(C)cc(Nc2nc(-c3cccnc3)cs2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is VQJWPJNIUQRXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3S/c1-11-6-12(2)8-14(7-11)18-16-19-15(10-20-16)13-4-3-5-17-9-13/h3-10H,1-2H3,(H,18,19).
What are the key properties of N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 281.38 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 58910456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).