5-phenyl-N-(2-phenylethyl)pentan-1-amine

C19H25N — CID 18703016

IUPAC5-phenyl-N-(2-phenylethyl)pentan-1-amine
SMILESc1ccc(CCCCCNCCc2ccccc2)cc1
InChIInChI=1S/C19H25N/c1-4-10-18(11-5-1)12-8-3-9-16-20-17-15-19-13-6-2-7-14-19/h1-2,4-7,10-11,13-14,20H,3,8-9,12,15-17H2
InChIKeyVEGXCFVNNCQPNX-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.23
Rot. Bonds9

About 5-phenyl-N-(2-phenylethyl)pentan-1-amine

5-phenyl-N-(2-phenylethyl)pentan-1-amine (PubChem CID 18703016) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 5-phenyl-N-(2-phenylethyl)pentan-1-amine.

Molecular Properties

Compound Name5-phenyl-N-(2-phenylethyl)pentan-1-amine
PubChem CID18703016
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name5-phenyl-N-(2-phenylethyl)pentan-1-amine
SMILESc1ccc(CCCCCNCCc2ccccc2)cc1
InChIInChI=1S/C19H25N/c1-4-10-18(11-5-1)12-8-3-9-16-20-17-15-19-13-6-2-7-14-19/h1-2,4-7,10-11,13-14,20H,3,8-9,12,15-17H2
InChIKeyVEGXCFVNNCQPNX-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.23
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 5-phenyl-N-(2-phenylethyl)pentan-1-amine?
The IUPAC name of 5-phenyl-N-(2-phenylethyl)pentan-1-amine (CID 18703016) is 5-phenyl-N-(2-phenylethyl)pentan-1-amine.
What is the SMILES notation for 5-phenyl-N-(2-phenylethyl)pentan-1-amine?
The canonical SMILES for 5-phenyl-N-(2-phenylethyl)pentan-1-amine is c1ccc(CCCCCNCCc2ccccc2)cc1.
What is the InChIKey of 5-phenyl-N-(2-phenylethyl)pentan-1-amine?
The InChIKey is VEGXCFVNNCQPNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-4-10-18(11-5-1)12-8-3-9-16-20-17-15-19-13-6-2-7-14-19/h1-2,4-7,10-11,13-14,20H,3,8-9,12,15-17H2.
What are the key properties of 5-phenyl-N-(2-phenylethyl)pentan-1-amine?
5-phenyl-N-(2-phenylethyl)pentan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.23, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-(2-phenylethyl)pentan-1-amine is sourced from PubChem (CID 18703016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).