N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine

C15H14N4S — CID 133433862

IUPACN-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCN(Cc1cnccn1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C15H14N4S/c1-19(10-13-9-16-7-8-17-13)15-18-14(11-20-15)12-5-3-2-4-6-12/h2-9,11H,10H2,1H3
InChIKeyTTYLOFVGDLDESG-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.24
Rot. Bonds4

About N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine

N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 133433862) has the molecular formula C15H14N4S and a molecular weight of 282.37 g/mol. Its IUPAC name is N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine
PubChem CID133433862
Molecular FormulaC15H14N4S
Molecular Weight282.37 g/mol
Exact Mass282.09
IUPAC NameN-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCN(Cc1cnccn1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C15H14N4S/c1-19(10-13-9-16-7-8-17-13)15-18-14(11-20-15)12-5-3-2-4-6-12/h2-9,11H,10H2,1H3
InChIKeyTTYLOFVGDLDESG-UHFFFAOYSA-N
XLogP3.24
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine (CID 133433862) is N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine is CN(Cc1cnccn1)c1nc(-c2ccccc2)cs1.
What is the InChIKey of N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is TTYLOFVGDLDESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4S/c1-19(10-13-9-16-7-8-17-13)15-18-14(11-20-15)12-5-3-2-4-6-12/h2-9,11H,10H2,1H3.
What are the key properties of N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine?
N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 282.37 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-phenyl-N-(pyrazin-2-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 133433862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).