2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide

C22H15ClN2O2 — CID 44549004

IUPAC2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ncc(-c3ccccc3)o2)cc1)c1ccccc1Cl
InChIInChI=1S/C22H15ClN2O2/c23-19-9-5-4-8-18(19)21(26)25-17-12-10-16(11-13-17)22-24-14-20(27-22)15-6-2-1-3-7-15/h1-14H,(H,25,26)
InChIKeyIMMNYJPTNIWRMO-UHFFFAOYSA-N
MW374.83 g/mol
LogP5.91
Rot. Bonds4

About 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide

2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide (PubChem CID 44549004) has the molecular formula C22H15ClN2O2 and a molecular weight of 374.83 g/mol. Its IUPAC name is 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide
PubChem CID44549004
Molecular FormulaC22H15ClN2O2
Molecular Weight374.83 g/mol
Exact Mass374.08
IUPAC Name2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ncc(-c3ccccc3)o2)cc1)c1ccccc1Cl
InChIInChI=1S/C22H15ClN2O2/c23-19-9-5-4-8-18(19)21(26)25-17-12-10-16(11-13-17)22-24-14-20(27-22)15-6-2-1-3-7-15/h1-14H,(H,25,26)
InChIKeyIMMNYJPTNIWRMO-UHFFFAOYSA-N
XLogP5.91
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.83
LogP ≤ 55.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide (CID 44549004) is 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide is O=C(Nc1ccc(-c2ncc(-c3ccccc3)o2)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide?
The InChIKey is IMMNYJPTNIWRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClN2O2/c23-19-9-5-4-8-18(19)21(26)25-17-12-10-16(11-13-17)22-24-14-20(27-22)15-6-2-1-3-7-15/h1-14H,(H,25,26).
What are the key properties of 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide?
2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide has a molecular weight of 374.83 g/mol, XLogP of 5.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 44549004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).