5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide

C20H13ClN4O2 — CID 163378777

IUPAC5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1)c1ccc(Cl)cn1
InChIInChI=1S/C20H13ClN4O2/c21-15-8-11-17(22-12-15)18(26)23-16-9-6-14(7-10-16)20-25-24-19(27-20)13-4-2-1-3-5-13/h1-12H,(H,23,26)
InChIKeyYHGDZJDOPBWDSA-UHFFFAOYSA-N
MW376.80 g/mol
LogP4.70
Rot. Bonds4

About 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide

5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide (PubChem CID 163378777) has the molecular formula C20H13ClN4O2 and a molecular weight of 376.80 g/mol. Its IUPAC name is 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide
PubChem CID163378777
Molecular FormulaC20H13ClN4O2
Molecular Weight376.80 g/mol
Exact Mass376.07
IUPAC Name5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1)c1ccc(Cl)cn1
InChIInChI=1S/C20H13ClN4O2/c21-15-8-11-17(22-12-15)18(26)23-16-9-6-14(7-10-16)20-25-24-19(27-20)13-4-2-1-3-5-13/h1-12H,(H,23,26)
InChIKeyYHGDZJDOPBWDSA-UHFFFAOYSA-N
XLogP4.70
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.80
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-tert-butylphenyl)-4-(3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl)benzamide
CID 44416415
N-(4-tert-butylphenyl)-4-[3-chloro-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 71466725
4-[3-chloro-5-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 71042916
N-[2-(4-Chlorophenyl)ethyl]-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162193
N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-2-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
CID 45783977
WO2022112139, Example 22
CID 163378782
2-({4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}methyl)-3-(4-ethylphenyl)-3H-imidazo[4,5-b]pyridine
CID 49666528
4-[5-[(6-Chloro-3-pyridinyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]aniline
CID 51348486
4-[5-[(6-chloro-3-pyridinyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethylaniline
CID 51348487
N-[(2-Chloro-4-fluorophenyl)methyl]-2-[5-(pyridin-2-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 52906403
N-(2-Chloro-4-fluorophenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162155
N-(2-Chloro-4-methylphenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162174

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide (CID 163378777) is 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide is O=C(Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1)c1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide?
The InChIKey is YHGDZJDOPBWDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13ClN4O2/c21-15-8-11-17(22-12-15)18(26)23-16-9-6-14(7-10-16)20-25-24-19(27-20)13-4-2-1-3-5-13/h1-12H,(H,23,26).
What are the key properties of 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide?
5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide has a molecular weight of 376.80 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 163378777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).