2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide

C15H22N4O2 — CID 154447735

IUPAC2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CN1CCN(c2ccccc2)CC1)C(N)=O
InChIInChI=1S/C15H22N4O2/c1-12(15(16)21)17-14(20)11-18-7-9-19(10-8-18)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,21)(H,17,20)
InChIKeyYDRXZTLTKFYUGA-UHFFFAOYSA-N
MW290.37 g/mol
LogP-0.20
Rot. Bonds5

About 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide

2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide (PubChem CID 154447735) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide.

Molecular Properties

Compound Name2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide
PubChem CID154447735
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CN1CCN(c2ccccc2)CC1)C(N)=O
InChIInChI=1S/C15H22N4O2/c1-12(15(16)21)17-14(20)11-18-7-9-19(10-8-18)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,21)(H,17,20)
InChIKeyYDRXZTLTKFYUGA-UHFFFAOYSA-N
XLogP-0.20
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-1-phenylpropyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 51284732
N-[2,6-di(propan-2-yl)phenyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 4797794
N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 8688385
N-(3-methylbutyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 109002098
N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 8688549
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
CID 6464684
2-(4-phenylpiperazin-1-yl)-N-(2-propan-2-ylphenyl)acetamide
CID 2653936
(2S)-2-[[2-[4-(trideuteriomethyl)piperazin-1-yl]acetyl]amino]propanamide
CID 178165345
N-[(1S)-1-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 98161251
N-(2-acetamidoethyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 36845543
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-propan-2-ylacetamide
CID 1439429
N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4-phenylpiperazin-1-yl)acetamide
CID 8688433

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide?
The IUPAC name of 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide (CID 154447735) is 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide.
What is the SMILES notation for 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide?
The canonical SMILES for 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide is CC(NC(=O)CN1CCN(c2ccccc2)CC1)C(N)=O.
What is the InChIKey of 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide?
The InChIKey is YDRXZTLTKFYUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-12(15(16)21)17-14(20)11-18-7-9-19(10-8-18)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,21)(H,17,20).
What are the key properties of 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide?
2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide has a molecular weight of 290.37 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]propanamide is sourced from PubChem (CID 154447735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).