N-benzyl-2-(4-chlorophenoxy)acetamide

C15H14ClNO2 — CID 2791617

IUPACN-benzyl-2-(4-chlorophenoxy)acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCc1ccccc1
InChIInChI=1S/C15H14ClNO2/c16-13-6-8-14(9-7-13)19-11-15(18)17-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18)
InChIKeySVVXCGZAOOWKAT-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.04
Rot. Bonds5

About N-benzyl-2-(4-chlorophenoxy)acetamide

N-benzyl-2-(4-chlorophenoxy)acetamide (PubChem CID 2791617) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is N-benzyl-2-(4-chlorophenoxy)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(4-chlorophenoxy)acetamide
PubChem CID2791617
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC NameN-benzyl-2-(4-chlorophenoxy)acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCc1ccccc1
InChIInChI=1S/C15H14ClNO2/c16-13-6-8-14(9-7-13)19-11-15(18)17-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18)
InChIKeySVVXCGZAOOWKAT-UHFFFAOYSA-N
XLogP3.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(4-chlorophenoxy)acetamide?
The IUPAC name of N-benzyl-2-(4-chlorophenoxy)acetamide (CID 2791617) is N-benzyl-2-(4-chlorophenoxy)acetamide.
What is the SMILES notation for N-benzyl-2-(4-chlorophenoxy)acetamide?
The canonical SMILES for N-benzyl-2-(4-chlorophenoxy)acetamide is O=C(COc1ccc(Cl)cc1)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(4-chlorophenoxy)acetamide?
The InChIKey is SVVXCGZAOOWKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c16-13-6-8-14(9-7-13)19-11-15(18)17-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18).
What are the key properties of N-benzyl-2-(4-chlorophenoxy)acetamide?
N-benzyl-2-(4-chlorophenoxy)acetamide has a molecular weight of 275.74 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(4-chlorophenoxy)acetamide is sourced from PubChem (CID 2791617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).