2-(1,1-diphenylethyl)propanediamide

C17H18N2O2 — CID 175584560

IUPAC2-(1,1-diphenylethyl)propanediamide
SMILESCC(c1ccccc1)(c1ccccc1)C(C(N)=O)C(N)=O
InChIInChI=1S/C17H18N2O2/c1-17(12-8-4-2-5-9-12,13-10-6-3-7-11-13)14(15(18)20)16(19)21/h2-11,14H,1H3,(H2,18,20)(H2,19,21)
InChIKeyYFBJLPYWFWCDIQ-UHFFFAOYSA-N
MW282.34 g/mol
LogP1.58
Rot. Bonds5

About 2-(1,1-diphenylethyl)propanediamide

2-(1,1-diphenylethyl)propanediamide (PubChem CID 175584560) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-(1,1-diphenylethyl)propanediamide.

Molecular Properties

Compound Name2-(1,1-diphenylethyl)propanediamide
PubChem CID175584560
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name2-(1,1-diphenylethyl)propanediamide
SMILESCC(c1ccccc1)(c1ccccc1)C(C(N)=O)C(N)=O
InChIInChI=1S/C17H18N2O2/c1-17(12-8-4-2-5-9-12,13-10-6-3-7-11-13)14(15(18)20)16(19)21/h2-11,14H,1H3,(H2,18,20)(H2,19,21)
InChIKeyYFBJLPYWFWCDIQ-UHFFFAOYSA-N
XLogP1.58
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2-(1,1-diphenylethyl)propanedioyl dichloride
CID 139978063
2-(aminomethyl)-3-methyl-3-phenylbutanamide
CID 139627038
2-(3-methyl-2,3-diphenylbutan-2-yl)propanedioic acid
CID 140623403
2-(2-acetylphenyl)-3-methyl-3-phenylbutanamide
CID 139637283
1,1-diphenylethyl carbamate
CID 20976713
(2S,3R)-3-amino-2-hydroxy-3-phenylbutanamide;2,2,2-trifluoroacetic acid
CID 161347199
2-methyl-2-phenylpropanethioamide
CID 59837413
2-cyano-3,3-diphenylbutanoic acid
CID 19781187
3-amino-2-methyl-2-phenylbutanoic acid
CID 67114284
3-amino-4,4-diphenylpentan-2-ol
CID 18533371
2-amino-N-(1-amino-1-oxopropan-2-yl)-2-phenylpropanamide
CID 62488756
2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]-2-phenylpropanamide
CID 120587567

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-diphenylethyl)propanediamide?
The IUPAC name of 2-(1,1-diphenylethyl)propanediamide (CID 175584560) is 2-(1,1-diphenylethyl)propanediamide.
What is the SMILES notation for 2-(1,1-diphenylethyl)propanediamide?
The canonical SMILES for 2-(1,1-diphenylethyl)propanediamide is CC(c1ccccc1)(c1ccccc1)C(C(N)=O)C(N)=O.
What is the InChIKey of 2-(1,1-diphenylethyl)propanediamide?
The InChIKey is YFBJLPYWFWCDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-17(12-8-4-2-5-9-12,13-10-6-3-7-11-13)14(15(18)20)16(19)21/h2-11,14H,1H3,(H2,18,20)(H2,19,21).
What are the key properties of 2-(1,1-diphenylethyl)propanediamide?
2-(1,1-diphenylethyl)propanediamide has a molecular weight of 282.34 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-diphenylethyl)propanediamide is sourced from PubChem (CID 175584560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).