N-[4-(2-aminopropanoyl)phenyl]propanamide

C12H16N2O2 — CID 82341614

IUPACN-[4-(2-aminopropanoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)C(C)N)cc1
InChIInChI=1S/C12H16N2O2/c1-3-11(15)14-10-6-4-9(5-7-10)12(16)8(2)13/h4-8H,3,13H2,1-2H3,(H,14,15)
InChIKeyPQMPUXIYQACZRB-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.57
Rot. Bonds4

About N-[4-(2-aminopropanoyl)phenyl]propanamide

N-[4-(2-aminopropanoyl)phenyl]propanamide (PubChem CID 82341614) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-[4-(2-aminopropanoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(2-aminopropanoyl)phenyl]propanamide
PubChem CID82341614
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-[4-(2-aminopropanoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)C(C)N)cc1
InChIInChI=1S/C12H16N2O2/c1-3-11(15)14-10-6-4-9(5-7-10)12(16)8(2)13/h4-8H,3,13H2,1-2H3,(H,14,15)
InChIKeyPQMPUXIYQACZRB-UHFFFAOYSA-N
XLogP1.57
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-aminopropanoyl)phenyl]propanamide?
The IUPAC name of N-[4-(2-aminopropanoyl)phenyl]propanamide (CID 82341614) is N-[4-(2-aminopropanoyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(2-aminopropanoyl)phenyl]propanamide?
The canonical SMILES for N-[4-(2-aminopropanoyl)phenyl]propanamide is CCC(=O)Nc1ccc(C(=O)C(C)N)cc1.
What is the InChIKey of N-[4-(2-aminopropanoyl)phenyl]propanamide?
The InChIKey is PQMPUXIYQACZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-3-11(15)14-10-6-4-9(5-7-10)12(16)8(2)13/h4-8H,3,13H2,1-2H3,(H,14,15).
What are the key properties of N-[4-(2-aminopropanoyl)phenyl]propanamide?
N-[4-(2-aminopropanoyl)phenyl]propanamide has a molecular weight of 220.27 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-aminopropanoyl)phenyl]propanamide is sourced from PubChem (CID 82341614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).