3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine

C24H27N — CID 14921509

IUPAC3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine
SMILESc1ccc(CCCNCCC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H27N/c1-4-11-21(12-5-1)13-10-19-25-20-18-24(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,11-12,14-17,24-25H,10,13,18-20H2
InChIKeyURZOIXVPUIVTPT-UHFFFAOYSA-N
MW329.49 g/mol
LogP5.43
Rot. Bonds9

About 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine

3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine (PubChem CID 14921509) has the molecular formula C24H27N and a molecular weight of 329.49 g/mol. Its IUPAC name is 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine.

Molecular Properties

Compound Name3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine
PubChem CID14921509
Molecular FormulaC24H27N
Molecular Weight329.49 g/mol
Exact Mass329.21
IUPAC Name3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine
SMILESc1ccc(CCCNCCC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H27N/c1-4-11-21(12-5-1)13-10-19-25-20-18-24(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,11-12,14-17,24-25H,10,13,18-20H2
InChIKeyURZOIXVPUIVTPT-UHFFFAOYSA-N
XLogP5.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.49
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine?
The IUPAC name of 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine (CID 14921509) is 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine.
What is the SMILES notation for 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine?
The canonical SMILES for 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine is c1ccc(CCCNCCC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine?
The InChIKey is URZOIXVPUIVTPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N/c1-4-11-21(12-5-1)13-10-19-25-20-18-24(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,11-12,14-17,24-25H,10,13,18-20H2.
What are the key properties of 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine?
3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine has a molecular weight of 329.49 g/mol, XLogP of 5.43, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-N-(3-phenylpropyl)propan-1-amine is sourced from PubChem (CID 14921509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).