N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide

C16H10N4O3 — CID 53317135

IUPACN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide
SMILESO=C(Nc1nnc(-c2ccco2)o1)c1ccnc2ccccc12
InChIInChI=1S/C16H10N4O3/c21-14(11-7-8-17-12-5-2-1-4-10(11)12)18-16-20-19-15(23-16)13-6-3-9-22-13/h1-9H,(H,18,20,21)
InChIKeyJBEIVBAFYCXWER-UHFFFAOYSA-N
MW306.28 g/mol
LogP3.13
Rot. Bonds3

About N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide

N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide (PubChem CID 53317135) has the molecular formula C16H10N4O3 and a molecular weight of 306.28 g/mol. Its IUPAC name is N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide
PubChem CID53317135
Molecular FormulaC16H10N4O3
Molecular Weight306.28 g/mol
Exact Mass306.08
IUPAC NameN-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide
SMILESO=C(Nc1nnc(-c2ccco2)o1)c1ccnc2ccccc12
InChIInChI=1S/C16H10N4O3/c21-14(11-7-8-17-12-5-2-1-4-10(11)12)18-16-20-19-15(23-16)13-6-3-9-22-13/h1-9H,(H,18,20,21)
InChIKeyJBEIVBAFYCXWER-UHFFFAOYSA-N
XLogP3.13
TPSA94.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.28
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl)-3-(pyridin-2-ylmethyl)urea
CID 71618700
Quinoline carboxamide derivative 1
CID 4253236
2-fluoro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]benzamide
CID 142440279
N-[5-(2-Furyl)-1,3,4-oxadiazol-2-yl]-2-(2-thienyl)-4-quinolinecarboxamide
CID 4253237
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-piperidin-1-ylquinoline-4-carboxamide
CID 44608079
N-[5-(2-Furyl)-1,3,4-oxadiazol-2-yl]-2-(1-naphthyl)-4-quinolinecarboxamide
CID 53318421
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 53318975
2-chloro-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide
CID 53319753
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 53321047
2-(2-Furyl)-N-[5-(2-furyl)-1,3,4-oxadiazol-2-yl]-4-quinolinecarboxamide
CID 53321048
Quinoline carboxamide derivative 3
CID 67204713
2-(furan-2-yl)-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
CID 122188901

Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide?
The IUPAC name of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide (CID 53317135) is N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide.
What is the SMILES notation for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide?
The canonical SMILES for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide is O=C(Nc1nnc(-c2ccco2)o1)c1ccnc2ccccc12.
What is the InChIKey of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide?
The InChIKey is JBEIVBAFYCXWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N4O3/c21-14(11-7-8-17-12-5-2-1-4-10(11)12)18-16-20-19-15(23-16)13-6-3-9-22-13/h1-9H,(H,18,20,21).
What are the key properties of N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide?
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide has a molecular weight of 306.28 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide is sourced from PubChem (CID 53317135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).