N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine

C15H12N6S — CID 155537763

IUPACN-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine
SMILESCc1cc(-c2n[nH]c3cc(Nc4nccs4)ncc23)ccn1
InChIInChI=1S/C15H12N6S/c1-9-6-10(2-3-16-9)14-11-8-18-13(7-12(11)20-21-14)19-15-17-4-5-22-15/h2-8H,1H3,(H,20,21)(H,17,18,19)
InChIKeyPLFAFIGPXQHXOG-UHFFFAOYSA-N
MW308.37 g/mol
LogP3.53
Rot. Bonds3

About N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine

N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine (PubChem CID 155537763) has the molecular formula C15H12N6S and a molecular weight of 308.37 g/mol. Its IUPAC name is N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine
PubChem CID155537763
Molecular FormulaC15H12N6S
Molecular Weight308.37 g/mol
Exact Mass308.08
IUPAC NameN-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine
SMILESCc1cc(-c2n[nH]c3cc(Nc4nccs4)ncc23)ccn1
InChIInChI=1S/C15H12N6S/c1-9-6-10(2-3-16-9)14-11-8-18-13(7-12(11)20-21-14)19-15-17-4-5-22-15/h2-8H,1H3,(H,20,21)(H,17,18,19)
InChIKeyPLFAFIGPXQHXOG-UHFFFAOYSA-N
XLogP3.53
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.37
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine?
The IUPAC name of N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine (CID 155537763) is N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine is Cc1cc(-c2n[nH]c3cc(Nc4nccs4)ncc23)ccn1.
What is the InChIKey of N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine?
The InChIKey is PLFAFIGPXQHXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N6S/c1-9-6-10(2-3-16-9)14-11-8-18-13(7-12(11)20-21-14)19-15-17-4-5-22-15/h2-8H,1H3,(H,20,21)(H,17,18,19).
What are the key properties of N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine?
N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine has a molecular weight of 308.37 g/mol, XLogP of 3.53, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 155537763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).