4,4,4-triphenylbutanamide

C22H21NO — CID 10215075

IUPAC4,4,4-triphenylbutanamide
SMILESNC(=O)CCC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H21NO/c23-21(24)16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2,(H2,23,24)
InChIKeyCFECKABWWANZMX-UHFFFAOYSA-N
MW315.42 g/mol
LogP4.29
Rot. Bonds6

About 4,4,4-triphenylbutanamide

4,4,4-triphenylbutanamide (PubChem CID 10215075) has the molecular formula C22H21NO and a molecular weight of 315.42 g/mol. Its IUPAC name is 4,4,4-triphenylbutanamide.

Molecular Properties

Compound Name4,4,4-triphenylbutanamide
PubChem CID10215075
Molecular FormulaC22H21NO
Molecular Weight315.42 g/mol
Exact Mass315.16
IUPAC Name4,4,4-triphenylbutanamide
SMILESNC(=O)CCC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H21NO/c23-21(24)16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2,(H2,23,24)
InChIKeyCFECKABWWANZMX-UHFFFAOYSA-N
XLogP4.29
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

CID 216327
CID 216327
CID 23603
CID 23603
CID 7625
CID 7625
CID 78420
CID 78420
CID 25255
CID 25255
CID 94713
CID 94713
CID 97606
CID 97606
CID 263363
CID 263363
CID 22915475
CID 22915475
CID 3983547
CID 3983547
CID 198947
CID 198947
CID 221297
CID 221297

Frequently Asked Questions

What is the IUPAC name of 4,4,4-triphenylbutanamide?
The IUPAC name of 4,4,4-triphenylbutanamide (CID 10215075) is 4,4,4-triphenylbutanamide.
What is the SMILES notation for 4,4,4-triphenylbutanamide?
The canonical SMILES for 4,4,4-triphenylbutanamide is NC(=O)CCC(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4,4,4-triphenylbutanamide?
The InChIKey is CFECKABWWANZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO/c23-21(24)16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2,(H2,23,24).
What are the key properties of 4,4,4-triphenylbutanamide?
4,4,4-triphenylbutanamide has a molecular weight of 315.42 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,4-triphenylbutanamide is sourced from PubChem (CID 10215075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).