2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide

C22H22N2O2 — CID 140529749

IUPAC2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide
SMILESO=C(CNCC(O)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22N2O2/c25-21(18-10-4-1-5-11-18)16-23-17-22(26)24(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21,23,25H,16-17H2
InChIKeyTUMDEFFBIFCEGL-UHFFFAOYSA-N
MW346.43 g/mol
LogP3.67
Rot. Bonds7

About 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide

2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide (PubChem CID 140529749) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide.

Molecular Properties

Compound Name2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide
PubChem CID140529749
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide
SMILESO=C(CNCC(O)c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22N2O2/c25-21(18-10-4-1-5-11-18)16-23-17-22(26)24(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21,23,25H,16-17H2
InChIKeyTUMDEFFBIFCEGL-UHFFFAOYSA-N
XLogP3.67
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]-1-phenylethanol
CID 902475
ethyl 2-[(2-hydroxy-2-phenylethyl)amino]acetate
CID 43393105
N,N-diphenyl-2-(1-phenylethylamino)acetamide
CID 68968814
2-(2-methylpropylamino)-1-phenylethanol
CID 3939463
2-[[2-[4-(dimethylamino)phenyl]-2-hydroxyethyl]amino]acetic acid
CID 82315419
2-[(2-hydroxy-2-phenylethyl)amino]-1-piperidin-1-ylethanone
CID 43392858
3-hydroxy-4-[(2-hydroxy-2-phenylethyl)amino]butanoic acid
CID 103238121
2-[(2-hydroxy-2-phenylethyl)amino]-N-(2-methylphenyl)acetamide
CID 43389775
(1S)-2-(ethylamino)-1-phenylethanol
CID 38989247
N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
CID 43389783
N-[3-[(2-hydroxy-2-phenylethyl)amino]propyl]acetamide
CID 82312079
1-phenyl-2-(2-phenylpropylamino)ethanol
CID 17158257

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide?
The IUPAC name of 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide (CID 140529749) is 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide.
What is the SMILES notation for 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide?
The canonical SMILES for 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide is O=C(CNCC(O)c1ccccc1)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide?
The InChIKey is TUMDEFFBIFCEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c25-21(18-10-4-1-5-11-18)16-23-17-22(26)24(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21,23,25H,16-17H2.
What are the key properties of 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide?
2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide has a molecular weight of 346.43 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-2-phenylethyl)amino]-N,N-diphenylacetamide is sourced from PubChem (CID 140529749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).