2-chloro-N-ethyl-N-phenylbenzamide

C15H14ClNO — CID 722355

IUPAC2-chloro-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1Cl)c1ccccc1
InChIInChI=1S/C15H14ClNO/c1-2-17(12-8-4-3-5-9-12)15(18)13-10-6-7-11-14(13)16/h3-11H,2H2,1H3
InChIKeyCLYJUAKTPOEIAZ-UHFFFAOYSA-N
MW259.74 g/mol
LogP4.01
Rot. Bonds3

About 2-chloro-N-ethyl-N-phenylbenzamide

2-chloro-N-ethyl-N-phenylbenzamide (PubChem CID 722355) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-phenylbenzamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-phenylbenzamide
PubChem CID722355
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name2-chloro-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1Cl)c1ccccc1
InChIInChI=1S/C15H14ClNO/c1-2-17(12-8-4-3-5-9-12)15(18)13-10-6-7-11-14(13)16/h3-11H,2H2,1H3
InChIKeyCLYJUAKTPOEIAZ-UHFFFAOYSA-N
XLogP4.01
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-phenylbenzamide?
The IUPAC name of 2-chloro-N-ethyl-N-phenylbenzamide (CID 722355) is 2-chloro-N-ethyl-N-phenylbenzamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-phenylbenzamide?
The canonical SMILES for 2-chloro-N-ethyl-N-phenylbenzamide is CCN(C(=O)c1ccccc1Cl)c1ccccc1.
What is the InChIKey of 2-chloro-N-ethyl-N-phenylbenzamide?
The InChIKey is CLYJUAKTPOEIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO/c1-2-17(12-8-4-3-5-9-12)15(18)13-10-6-7-11-14(13)16/h3-11H,2H2,1H3.
What are the key properties of 2-chloro-N-ethyl-N-phenylbenzamide?
2-chloro-N-ethyl-N-phenylbenzamide has a molecular weight of 259.74 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-phenylbenzamide is sourced from PubChem (CID 722355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).