4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide

C10H9ClN4O2 — CID 103743986

IUPAC4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1ncno1)c1cc(Cl)ccn1
InChIInChI=1S/C10H9ClN4O2/c11-7-1-3-12-8(5-7)10(16)13-4-2-9-14-6-15-17-9/h1,3,5-6H,2,4H2,(H,13,16)
InChIKeyBJXKVLMIVXGNED-UHFFFAOYSA-N
MW252.66 g/mol
LogP1.09
Rot. Bonds4

About 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide

4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide (PubChem CID 103743986) has the molecular formula C10H9ClN4O2 and a molecular weight of 252.66 g/mol. Its IUPAC name is 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
PubChem CID103743986
Molecular FormulaC10H9ClN4O2
Molecular Weight252.66 g/mol
Exact Mass252.04
IUPAC Name4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCc1ncno1)c1cc(Cl)ccn1
InChIInChI=1S/C10H9ClN4O2/c11-7-1-3-12-8(5-7)10(16)13-4-2-9-14-6-15-17-9/h1,3,5-6H,2,4H2,(H,13,16)
InChIKeyBJXKVLMIVXGNED-UHFFFAOYSA-N
XLogP1.09
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.66
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-4-carboxamide
CID 103743995
6-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
CID 103744039
4-chloro-N-[2-(3,5-difluorophenyl)ethyl]pyridine-2-carboxamide
CID 62297092
4-chloro-N-[2-(1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
CID 62186873
6-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-3-carboxamide
CID 103744003
N-(3-aminopropyl)-4-chloropyridine-2-carboxamide
CID 61247982
6-fluoro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
CID 103873715
2,6-dihydroxy-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 103890610
4-chloro-N-[2-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 31799254
4-chloro-N-hexylpyridine-2-carboxamide
CID 60656473
2-(methylamino)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-3-carboxamide
CID 106408720
5-bromo-2-fluoro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 103744021

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide (CID 103743986) is 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide is O=C(NCCc1ncno1)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is BJXKVLMIVXGNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4O2/c11-7-1-3-12-8(5-7)10(16)13-4-2-9-14-6-15-17-9/h1,3,5-6H,2,4H2,(H,13,16).
What are the key properties of 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?
4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 252.66 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 103743986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).