N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide

C17H24N2O2 — CID 11277680

IUPACN-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide
SMILESCCCC(C(=O)c1ccc(NC(C)=O)cc1)N1CCCC1
InChIInChI=1S/C17H24N2O2/c1-3-6-16(19-11-4-5-12-19)17(21)14-7-9-15(10-8-14)18-13(2)20/h7-10,16H,3-6,11-12H2,1-2H3,(H,18,20)
InChIKeyDSIUMNNVBQZCEG-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.09
Rot. Bonds6

About N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide

N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide (PubChem CID 11277680) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide
PubChem CID11277680
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide
SMILESCCCC(C(=O)c1ccc(NC(C)=O)cc1)N1CCCC1
InChIInChI=1S/C17H24N2O2/c1-3-6-16(19-11-4-5-12-19)17(21)14-7-9-15(10-8-14)18-13(2)20/h7-10,16H,3-6,11-12H2,1-2H3,(H,18,20)
InChIKeyDSIUMNNVBQZCEG-UHFFFAOYSA-N
XLogP3.09
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide?
The IUPAC name of N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide (CID 11277680) is N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide?
The canonical SMILES for N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide is CCCC(C(=O)c1ccc(NC(C)=O)cc1)N1CCCC1.
What is the InChIKey of N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide?
The InChIKey is DSIUMNNVBQZCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-6-16(19-11-4-5-12-19)17(21)14-7-9-15(10-8-14)18-13(2)20/h7-10,16H,3-6,11-12H2,1-2H3,(H,18,20).
What are the key properties of N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide?
N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide has a molecular weight of 288.39 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-pyrrolidin-1-ylpentanoyl)phenyl]acetamide is sourced from PubChem (CID 11277680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).