6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine

C13H11N3S — CID 132581595

IUPAC6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine
SMILESCc1ccc2nc(Nc3ccccn3)sc2c1
InChIInChI=1S/C13H11N3S/c1-9-5-6-10-11(8-9)17-13(15-10)16-12-4-2-3-7-14-12/h2-8H,1H3,(H,14,15,16)
InChIKeyMLZOKTSPKCVRAI-UHFFFAOYSA-N
MW241.32 g/mol
LogP3.74
Rot. Bonds2

About 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine

6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine (PubChem CID 132581595) has the molecular formula C13H11N3S and a molecular weight of 241.32 g/mol. Its IUPAC name is 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine.

Molecular Properties

Compound Name6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine
PubChem CID132581595
Molecular FormulaC13H11N3S
Molecular Weight241.32 g/mol
Exact Mass241.07
IUPAC Name6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine
SMILESCc1ccc2nc(Nc3ccccn3)sc2c1
InChIInChI=1S/C13H11N3S/c1-9-5-6-10-11(8-9)17-13(15-10)16-12-4-2-3-7-14-12/h2-8H,1H3,(H,14,15,16)
InChIKeyMLZOKTSPKCVRAI-UHFFFAOYSA-N
XLogP3.74
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine
CID 132581598
N-(6-chloro-2-pyridinyl)-6-methyl-1,3-benzothiazol-2-amine
CID 87379371
6-methyl-N-(4-methylphenyl)-1,3-benzothiazol-2-amine
CID 12955114
2-methyl-N-pyridin-2-yl-1,3-benzothiazol-6-amine
CID 90997586
6-methyl-N-(2,4,6-trimethylphenyl)-1,3-benzothiazol-2-amine
CID 79142410
N-propyl-2-(pyridin-2-ylamino)-1,3-benzothiazole-6-carboxamide
CID 117092605
4-N-(6-methyl-1,3-benzothiazol-2-yl)-6-N-(4-methyl-2-pyridinyl)pyrimidine-4,5,6-triamine
CID 22545208
N-(4-tert-butylphenyl)-6-methyl-1,3-benzothiazol-2-amine
CID 79127962
N-(2-chloro-5-methylphenyl)-6-methyl-1,3-benzothiazol-2-amine
CID 107637469
4-[[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-pyridinyl]amino]cyclohexan-1-ol
CID 53379572
N-(2,5-dibromophenyl)-6-methyl-1,3-benzothiazol-2-amine
CID 79142921
6-methyl-N-(2,4,5-trichlorophenyl)-1,3-benzothiazol-2-amine
CID 78908955

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine?
The IUPAC name of 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine (CID 132581595) is 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine.
What is the SMILES notation for 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine?
The canonical SMILES for 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine is Cc1ccc2nc(Nc3ccccn3)sc2c1.
What is the InChIKey of 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine?
The InChIKey is MLZOKTSPKCVRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3S/c1-9-5-6-10-11(8-9)17-13(15-10)16-12-4-2-3-7-14-12/h2-8H,1H3,(H,14,15,16).
What are the key properties of 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine?
6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine has a molecular weight of 241.32 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-pyridin-2-yl-1,3-benzothiazol-2-amine is sourced from PubChem (CID 132581595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).