5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine

C15H13N3S — CID 172821030

IUPAC5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cc(-c3ccccc3)ccn2)s1
InChIInChI=1S/C15H13N3S/c1-11-10-17-15(19-11)18-14-9-13(7-8-16-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,17,18)
InChIKeyUFMWSJWLQRDNDO-UHFFFAOYSA-N
MW267.36 g/mol
LogP4.26
Rot. Bonds3

About 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine

5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 172821030) has the molecular formula C15H13N3S and a molecular weight of 267.36 g/mol. Its IUPAC name is 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine
PubChem CID172821030
Molecular FormulaC15H13N3S
Molecular Weight267.36 g/mol
Exact Mass267.08
IUPAC Name5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cc(-c3ccccc3)ccn2)s1
InChIInChI=1S/C15H13N3S/c1-11-10-17-15(19-11)18-14-9-13(7-8-16-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,17,18)
InChIKeyUFMWSJWLQRDNDO-UHFFFAOYSA-N
XLogP4.26
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine (CID 172821030) is 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine is Cc1cnc(Nc2cc(-c3ccccc3)ccn2)s1.
What is the InChIKey of 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is UFMWSJWLQRDNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3S/c1-11-10-17-15(19-11)18-14-9-13(7-8-16-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,17,18).
What are the key properties of 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine?
5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 267.36 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 172821030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).