2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide

C16H18FN7O — CID 166363051

IUPAC2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide
SMILESO=C(Cc1cn2cc(F)ccc2n1)Nc1n[nH]c(C2CCNCC2)n1
InChIInChI=1S/C16H18FN7O/c17-11-1-2-13-19-12(9-24(13)8-11)7-14(25)20-16-21-15(22-23-16)10-3-5-18-6-4-10/h1-2,8-10,18H,3-7H2,(H2,20,21,22,23,25)
InChIKeyVYVCLGWYTOENNO-UHFFFAOYSA-N
MW343.37 g/mol
LogP1.24
Rot. Bonds4

About 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide

2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide (PubChem CID 166363051) has the molecular formula C16H18FN7O and a molecular weight of 343.37 g/mol. Its IUPAC name is 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide
PubChem CID166363051
Molecular FormulaC16H18FN7O
Molecular Weight343.37 g/mol
Exact Mass343.16
IUPAC Name2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide
SMILESO=C(Cc1cn2cc(F)ccc2n1)Nc1n[nH]c(C2CCNCC2)n1
InChIInChI=1S/C16H18FN7O/c17-11-1-2-13-19-12(9-24(13)8-11)7-14(25)20-16-21-15(22-23-16)10-3-5-18-6-4-10/h1-2,8-10,18H,3-7H2,(H2,20,21,22,23,25)
InChIKeyVYVCLGWYTOENNO-UHFFFAOYSA-N
XLogP1.24
TPSA100.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.37
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide?
The IUPAC name of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide (CID 166363051) is 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide.
What is the SMILES notation for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide?
The canonical SMILES for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide is O=C(Cc1cn2cc(F)ccc2n1)Nc1n[nH]c(C2CCNCC2)n1.
What is the InChIKey of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide?
The InChIKey is VYVCLGWYTOENNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN7O/c17-11-1-2-13-19-12(9-24(13)8-11)7-14(25)20-16-21-15(22-23-16)10-3-5-18-6-4-10/h1-2,8-10,18H,3-7H2,(H2,20,21,22,23,25).
What are the key properties of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide?
2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide has a molecular weight of 343.37 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide is sourced from PubChem (CID 166363051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).