N-pentyl-N-(2-phenylethyl)acetamide

C15H23NO — CID 46205529

IUPACN-pentyl-N-(2-phenylethyl)acetamide
SMILESCCCCCN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C15H23NO/c1-3-4-8-12-16(14(2)17)13-11-15-9-6-5-7-10-15/h5-7,9-10H,3-4,8,11-13H2,1-2H3
InChIKeyBHNXEQPFMXOOEN-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.27
Rot. Bonds7

About N-pentyl-N-(2-phenylethyl)acetamide

N-pentyl-N-(2-phenylethyl)acetamide (PubChem CID 46205529) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-pentyl-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-pentyl-N-(2-phenylethyl)acetamide
PubChem CID46205529
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-pentyl-N-(2-phenylethyl)acetamide
SMILESCCCCCN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C15H23NO/c1-3-4-8-12-16(14(2)17)13-11-15-9-6-5-7-10-15/h5-7,9-10H,3-4,8,11-13H2,1-2H3
InChIKeyBHNXEQPFMXOOEN-UHFFFAOYSA-N
XLogP3.27
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.27
H-Bond Donors ≤ 50
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 N-pentyl-N-(2-phenylethyl)acetamide?
The IUPAC name of N-pentyl-N-(2-phenylethyl)acetamide (CID 46205529) is N-pentyl-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-pentyl-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-pentyl-N-(2-phenylethyl)acetamide is CCCCCN(CCc1ccccc1)C(C)=O.
What is the InChIKey of N-pentyl-N-(2-phenylethyl)acetamide?
The InChIKey is BHNXEQPFMXOOEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-4-8-12-16(14(2)17)13-11-15-9-6-5-7-10-15/h5-7,9-10H,3-4,8,11-13H2,1-2H3.
What are the key properties of N-pentyl-N-(2-phenylethyl)acetamide?
N-pentyl-N-(2-phenylethyl)acetamide has a molecular weight of 233.36 g/mol, XLogP of 3.27, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 46205529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).