2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide

C18H22N2O2 — CID 110877202

IUPAC2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide
SMILESO=C(CN(CCO)c1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H22N2O2/c21-14-13-20(17-9-5-2-6-10-17)15-18(22)19-12-11-16-7-3-1-4-8-16/h1-10,21H,11-15H2,(H,19,22)
InChIKeyRXRSMJFWUVNJRI-UHFFFAOYSA-N
MW298.39 g/mol
LogP1.84
Rot. Bonds8

About 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide

2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide (PubChem CID 110877202) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide
PubChem CID110877202
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide
SMILESO=C(CN(CCO)c1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H22N2O2/c21-14-13-20(17-9-5-2-6-10-17)15-18(22)19-12-11-16-7-3-1-4-8-16/h1-10,21H,11-15H2,(H,19,22)
InChIKeyRXRSMJFWUVNJRI-UHFFFAOYSA-N
XLogP1.84
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide (CID 110877202) is 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide is O=C(CN(CCO)c1ccccc1)NCCc1ccccc1.
What is the InChIKey of 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide?
The InChIKey is RXRSMJFWUVNJRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c21-14-13-20(17-9-5-2-6-10-17)15-18(22)19-12-11-16-7-3-1-4-8-16/h1-10,21H,11-15H2,(H,19,22).
What are the key properties of 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide?
2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide has a molecular weight of 298.39 g/mol, XLogP of 1.84, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 110877202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).