N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide

C32H34N2O — CID 16658831

IUPACN-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide
SMILESO=C(CNCCC(c1ccccc1)c1ccccc1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H34N2O/c35-32(34-24-22-31(28-17-9-3-10-18-28)29-19-11-4-12-20-29)25-33-23-21-30(26-13-5-1-6-14-26)27-15-7-2-8-16-27/h1-20,30-31,33H,21-25H2,(H,34,35)
InChIKeyFVCTVZAGIWTLTB-UHFFFAOYSA-N
MW462.64 g/mol
LogP6.14
Rot. Bonds12

About N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide

N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide (PubChem CID 16658831) has the molecular formula C32H34N2O and a molecular weight of 462.64 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide
PubChem CID16658831
Molecular FormulaC32H34N2O
Molecular Weight462.64 g/mol
Exact Mass462.27
IUPAC NameN-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide
SMILESO=C(CNCCC(c1ccccc1)c1ccccc1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H34N2O/c35-32(34-24-22-31(28-17-9-3-10-18-28)29-19-11-4-12-20-29)25-33-23-21-30(26-13-5-1-6-14-26)27-15-7-2-8-16-27/h1-20,30-31,33H,21-25H2,(H,34,35)
InChIKeyFVCTVZAGIWTLTB-UHFFFAOYSA-N
XLogP6.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.64
LogP ≤ 56.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide?
The IUPAC name of N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide (CID 16658831) is N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide is O=C(CNCCC(c1ccccc1)c1ccccc1)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide?
The InChIKey is FVCTVZAGIWTLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34N2O/c35-32(34-24-22-31(28-17-9-3-10-18-28)29-19-11-4-12-20-29)25-33-23-21-30(26-13-5-1-6-14-26)27-15-7-2-8-16-27/h1-20,30-31,33H,21-25H2,(H,34,35).
What are the key properties of N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide?
N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide has a molecular weight of 462.64 g/mol, XLogP of 6.14, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-2-(3,3-diphenylpropylamino)acetamide is sourced from PubChem (CID 16658831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).