4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide

C18H13ClN2O2 — CID 163208536

IUPAC4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide
SMILESNC(=O)c1ccc(Cl)cc1-c1ccc(Oc2ccccc2)cn1
InChIInChI=1S/C18H13ClN2O2/c19-12-6-8-15(18(20)22)16(10-12)17-9-7-14(11-21-17)23-13-4-2-1-3-5-13/h1-11H,(H2,20,22)
InChIKeyUVMRRLICKIAGBM-UHFFFAOYSA-N
MW324.77 g/mol
LogP4.29
Rot. Bonds4

About 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide

4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide (PubChem CID 163208536) has the molecular formula C18H13ClN2O2 and a molecular weight of 324.77 g/mol. Its IUPAC name is 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide
PubChem CID163208536
Molecular FormulaC18H13ClN2O2
Molecular Weight324.77 g/mol
Exact Mass324.07
IUPAC Name4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide
SMILESNC(=O)c1ccc(Cl)cc1-c1ccc(Oc2ccccc2)cn1
InChIInChI=1S/C18H13ClN2O2/c19-12-6-8-15(18(20)22)16(10-12)17-9-7-14(11-21-17)23-13-4-2-1-3-5-13/h1-11H,(H2,20,22)
InChIKeyUVMRRLICKIAGBM-UHFFFAOYSA-N
XLogP4.29
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.77
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide?
The IUPAC name of 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide (CID 163208536) is 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide.
What is the SMILES notation for 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide?
The canonical SMILES for 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide is NC(=O)c1ccc(Cl)cc1-c1ccc(Oc2ccccc2)cn1.
What is the InChIKey of 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide?
The InChIKey is UVMRRLICKIAGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN2O2/c19-12-6-8-15(18(20)22)16(10-12)17-9-7-14(11-21-17)23-13-4-2-1-3-5-13/h1-11H,(H2,20,22).
What are the key properties of 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide?
4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide has a molecular weight of 324.77 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(5-phenoxy-2-pyridinyl)benzamide is sourced from PubChem (CID 163208536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).