2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide

C14H18N4O — CID 38312923

IUPAC2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
SMILESO=C(CC1CCCCC1)Nc1nnc2ccccn12
InChIInChI=1S/C14H18N4O/c19-13(10-11-6-2-1-3-7-11)15-14-17-16-12-8-4-5-9-18(12)14/h4-5,8-9,11H,1-3,6-7,10H2,(H,15,17,19)
InChIKeyZIVYRILXYWRFKK-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.64
Rot. Bonds3

About 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide

2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide (PubChem CID 38312923) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
PubChem CID38312923
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
SMILESO=C(CC1CCCCC1)Nc1nnc2ccccn12
InChIInChI=1S/C14H18N4O/c19-13(10-11-6-2-1-3-7-11)15-14-17-16-12-8-4-5-9-18(12)14/h4-5,8-9,11H,1-3,6-7,10H2,(H,15,17,19)
InChIKeyZIVYRILXYWRFKK-UHFFFAOYSA-N
XLogP2.64
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The IUPAC name of 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide (CID 38312923) is 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The canonical SMILES for 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide is O=C(CC1CCCCC1)Nc1nnc2ccccn12.
What is the InChIKey of 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The InChIKey is ZIVYRILXYWRFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c19-13(10-11-6-2-1-3-7-11)15-14-17-16-12-8-4-5-9-18(12)14/h4-5,8-9,11H,1-3,6-7,10H2,(H,15,17,19).
What are the key properties of 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 38312923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).