N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide

C14H13N5O3S — CID 25128663

IUPACN-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cncc(S(C)(=O)=O)c3)cn2n1
InChIInChI=1S/C14H13N5O3S/c1-9(20)16-14-17-13-4-3-10(8-19(13)18-14)11-5-12(7-15-6-11)23(2,21)22/h3-8H,1-2H3,(H,16,18,20)
InChIKeyRCRCKEODQLBHAY-UHFFFAOYSA-N
MW331.36 g/mol
LogP1.15
Rot. Bonds3

About N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide

N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (PubChem CID 25128663) has the molecular formula C14H13N5O3S and a molecular weight of 331.36 g/mol. Its IUPAC name is N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
PubChem CID25128663
Molecular FormulaC14H13N5O3S
Molecular Weight331.36 g/mol
Exact Mass331.07
IUPAC NameN-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1nc2ccc(-c3cncc(S(C)(=O)=O)c3)cn2n1
InChIInChI=1S/C14H13N5O3S/c1-9(20)16-14-17-13-4-3-10(8-19(13)18-14)11-5-12(7-15-6-11)23(2,21)22/h3-8H,1-2H3,(H,16,18,20)
InChIKeyRCRCKEODQLBHAY-UHFFFAOYSA-N
XLogP1.15
TPSA106.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.36
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Cep-33779
CID 57336812
Czc-24832
CID 42623951
8-(4-Methylsulfonylphenyl)-N-(4-Morpholin-4-Ylphenyl)-[1,2,4]triazolo[1,5-A]pyridin-2-Amine
CID 49838138
N-{3-[(1,1-dioxidothiomorpholin-4-yl)methyl]phenyl}-8-[4-(methylsulfonyl)phenyl][1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 49838516
[8-(4-Methanesulfonyl-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-[3-(1-methyl-piperidin-4-yl)-phenyl]-amine
CID 57502388
N-[6-[3-(methanesulfonamido)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
CID 25129386
N-(6-thiophen-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)acetamide
CID 25129734
N-[6-(3-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
CID 25132804
N-(6-(Pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl)acetamide
CID 25133141
6-(5-(Methylsulfonyl)pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 42623219
5-(2-Amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-tert-butylpyridine-3-sulfonamide
CID 42623223
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-benzylpyridine-3-sulfonamide
CID 42623224

Frequently Asked Questions

What is the IUPAC name of N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide (CID 25128663) is N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is CC(=O)Nc1nc2ccc(-c3cncc(S(C)(=O)=O)c3)cn2n1.
What is the InChIKey of N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
The InChIKey is RCRCKEODQLBHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O3S/c1-9(20)16-14-17-13-4-3-10(8-19(13)18-14)11-5-12(7-15-6-11)23(2,21)22/h3-8H,1-2H3,(H,16,18,20).
What are the key properties of N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide?
N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide has a molecular weight of 331.36 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 25128663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).