4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide

C18H20N2O3 — CID 110890234

IUPAC4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide
SMILESNC(=O)CCCNC(=O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O3/c19-16(21)12-7-13-20-17(22)18(23,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,23H,7,12-13H2,(H2,19,21)(H,20,22)
InChIKeyZFVFGJPIYHIHSJ-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.30
Rot. Bonds7

About 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide

4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide (PubChem CID 110890234) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide.

Molecular Properties

Compound Name4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide
PubChem CID110890234
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide
SMILESNC(=O)CCCNC(=O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O3/c19-16(21)12-7-13-20-17(22)18(23,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,23H,7,12-13H2,(H2,19,21)(H,20,22)
InChIKeyZFVFGJPIYHIHSJ-UHFFFAOYSA-N
XLogP1.30
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide
CID 110887930
4-anilinobutanamide
CID 67066705
2-hydroxy-2,2-diphenyl-N-prop-2-ynylacetamide
CID 15023456
[(2-hydroxy-2,2-diphenylacetyl)amino]methyl (3S)-3,4-diamino-4-oxobutanoate;hydrochloride
CID 139920455
2-hydroxy-N-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-2,2-diphenylacetamide
CID 15458689
N-(4-bromobutyl)-2-methyl-2-phenylpropanamide
CID 106845643
7-[(2-methoxy-2-phenylpropanoyl)amino]heptanoic acid
CID 119227666
4-[(3-amino-3-phenylpropanoyl)amino]butanamide
CID 60865046
N-[2-[(2-amino-2-phenylpropanoyl)amino]ethyl]-2,2-dimethylpropanamide
CID 120591033
4-amino-N-(4-amino-4-oxobutyl)-4-phenylbutanamide
CID 63323993
2-[(4-amino-4-oxobutyl)carbamoylamino]benzoic acid
CID 61204569
5-(benzylcarbamoylamino)pentanamide
CID 106235188

Frequently Asked Questions

What is the IUPAC name of 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide?
The IUPAC name of 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide (CID 110890234) is 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide.
What is the SMILES notation for 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide?
The canonical SMILES for 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide is NC(=O)CCCNC(=O)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide?
The InChIKey is ZFVFGJPIYHIHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c19-16(21)12-7-13-20-17(22)18(23,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,23H,7,12-13H2,(H2,19,21)(H,20,22).
What are the key properties of 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide?
4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide has a molecular weight of 312.37 g/mol, XLogP of 1.30, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-hydroxy-2,2-diphenylacetyl)amino]butanamide is sourced from PubChem (CID 110890234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).