N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide

C22H20ClNO — CID 3107149

IUPACN-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide
SMILESO=C(NCCc1ccc(Cl)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20ClNO/c23-20-13-11-17(12-14-20)15-16-24-22(25)21(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-14,21H,15-16H2,(H,24,25)
InChIKeyKSSLXUWPVXYGNI-UHFFFAOYSA-N
MW349.86 g/mol
LogP4.83
Rot. Bonds6

About N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide

N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide (PubChem CID 3107149) has the molecular formula C22H20ClNO and a molecular weight of 349.86 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide
PubChem CID3107149
Molecular FormulaC22H20ClNO
Molecular Weight349.86 g/mol
Exact Mass349.12
IUPAC NameN-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide
SMILESO=C(NCCc1ccc(Cl)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20ClNO/c23-20-13-11-17(12-14-20)15-16-24-22(25)21(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-14,21H,15-16H2,(H,24,25)
InChIKeyKSSLXUWPVXYGNI-UHFFFAOYSA-N
XLogP4.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.86
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide?
The IUPAC name of N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide (CID 3107149) is N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide is O=C(NCCc1ccc(Cl)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide?
The InChIKey is KSSLXUWPVXYGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClNO/c23-20-13-11-17(12-14-20)15-16-24-22(25)21(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-14,21H,15-16H2,(H,24,25).
What are the key properties of N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide?
N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide has a molecular weight of 349.86 g/mol, XLogP of 4.83, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)ethyl]-2,2-diphenylacetamide is sourced from PubChem (CID 3107149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).