2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide

C17H20N2O — CID 43724073

IUPAC2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide
SMILESCCc1ccc(CNc2ccc(CC(N)=O)cc2)cc1
InChIInChI=1S/C17H20N2O/c1-2-13-3-5-15(6-4-13)12-19-16-9-7-14(8-10-16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20)
InChIKeyWUPBZMPOMMUXPC-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.89
Rot. Bonds6

About 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide

2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide (PubChem CID 43724073) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide
PubChem CID43724073
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide
SMILESCCc1ccc(CNc2ccc(CC(N)=O)cc2)cc1
InChIInChI=1S/C17H20N2O/c1-2-13-3-5-15(6-4-13)12-19-16-9-7-14(8-10-16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20)
InChIKeyWUPBZMPOMMUXPC-UHFFFAOYSA-N
XLogP2.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide?
The IUPAC name of 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide (CID 43724073) is 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide.
What is the SMILES notation for 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide?
The canonical SMILES for 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide is CCc1ccc(CNc2ccc(CC(N)=O)cc2)cc1.
What is the InChIKey of 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide?
The InChIKey is WUPBZMPOMMUXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-13-3-5-15(6-4-13)12-19-16-9-7-14(8-10-16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20).
What are the key properties of 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide?
2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide is sourced from PubChem (CID 43724073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).