5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide

C19H13ClN4O3 — CID 148562905

IUPAC5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide
SMILESCc1ccc(Cl)cc1C(=O)Nc1cncc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C19H13ClN4O3/c1-11-4-5-13(20)8-15(11)17(25)22-14-7-12(9-21-10-14)18-23-24-19(27-18)16-3-2-6-26-16/h2-10H,1H3,(H,22,25)
InChIKeyMVIPMPTWJUABDK-UHFFFAOYSA-N
MW380.79 g/mol
LogP4.61
Rot. Bonds4

About 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide

5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide (PubChem CID 148562905) has the molecular formula C19H13ClN4O3 and a molecular weight of 380.79 g/mol. Its IUPAC name is 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide.

Molecular Properties

Compound Name5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide
PubChem CID148562905
Molecular FormulaC19H13ClN4O3
Molecular Weight380.79 g/mol
Exact Mass380.07
IUPAC Name5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide
SMILESCc1ccc(Cl)cc1C(=O)Nc1cncc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C19H13ClN4O3/c1-11-4-5-13(20)8-15(11)17(25)22-14-7-12(9-21-10-14)18-23-24-19(27-18)16-3-2-6-26-16/h2-10H,1H3,(H,22,25)
InChIKeyMVIPMPTWJUABDK-UHFFFAOYSA-N
XLogP4.61
TPSA94.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.79
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-N-[3-chloro-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxybenzamide
CID 146494644
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-4-methylphenyl]benzamide
CID 142440259
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
CID 142440284
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2,5-dimethylbenzamide
CID 4129515
5-chloro-N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-2-methoxybenzamide
CID 142440199
methyl 2-[[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]carbamoyl]benzoate
CID 146494289
5-chloro-2-ethoxy-N-[2-fluoro-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
CID 135347176
5-chloro-N-[2-fluoro-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxypyridine-3-carboxamide
CID 142440146
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-4-hydroxybenzamide
CID 142440315
ethane;N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxy-5-methylbenzamide
CID 142440037
N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-prop-1-ynylbenzamide
CID 146493966
N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
CID 142440189

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide?
The IUPAC name of 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide (CID 148562905) is 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide.
What is the SMILES notation for 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide?
The canonical SMILES for 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide is Cc1ccc(Cl)cc1C(=O)Nc1cncc(-c2nnc(-c3ccco3)o2)c1.
What is the InChIKey of 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide?
The InChIKey is MVIPMPTWJUABDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN4O3/c1-11-4-5-13(20)8-15(11)17(25)22-14-7-12(9-21-10-14)18-23-24-19(27-18)16-3-2-6-26-16/h2-10H,1H3,(H,22,25).
What are the key properties of 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide?
5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide has a molecular weight of 380.79 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide is sourced from PubChem (CID 148562905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).