N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

C14H12N4S — CID 972880

IUPACN-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCc1cccnc1Nc1nc(-c2ccccn2)cs1
InChIInChI=1S/C14H12N4S/c1-10-5-4-8-16-13(10)18-14-17-12(9-19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18)
InChIKeyAUWIYYMLXLLRIY-UHFFFAOYSA-N
MW268.35 g/mol
LogP3.65
Rot. Bonds3

About N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 972880) has the molecular formula C14H12N4S and a molecular weight of 268.35 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID972880
Molecular FormulaC14H12N4S
Molecular Weight268.35 g/mol
Exact Mass268.08
IUPAC NameN-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCc1cccnc1Nc1nc(-c2ccccn2)cs1
InChIInChI=1S/C14H12N4S/c1-10-5-4-8-16-13(10)18-14-17-12(9-19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18)
InChIKeyAUWIYYMLXLLRIY-UHFFFAOYSA-N
XLogP3.65
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (CID 972880) is N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is Cc1cccnc1Nc1nc(-c2ccccn2)cs1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is AUWIYYMLXLLRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4S/c1-10-5-4-8-16-13(10)18-14-17-12(9-19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18).
What are the key properties of N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 268.35 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 972880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).