2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide

C14H28N4O2 — CID 60936804

IUPAC2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCN(C(=O)C(N)CCC)CC1
InChIInChI=1S/C14H28N4O2/c1-3-5-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16-6-4-2/h12H,3-11,15H2,1-2H3,(H,16,19)
InChIKeyWODWIADULPASBX-UHFFFAOYSA-N
MW284.40 g/mol
LogP-0.22
Rot. Bonds7

About 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide

2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide (PubChem CID 60936804) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide
PubChem CID60936804
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC Name2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCN(C(=O)C(N)CCC)CC1
InChIInChI=1S/C14H28N4O2/c1-3-5-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16-6-4-2/h12H,3-11,15H2,1-2H3,(H,16,19)
InChIKeyWODWIADULPASBX-UHFFFAOYSA-N
XLogP-0.22
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(2S)-2-amino-3,3-dimethylbutanoyl]piperazin-1-yl]-N-propylacetamide
CID 61165020
2-[4-(2-propan-2-ylsulfonylpropanoyl)piperazin-1-yl]-N-propylacetamide
CID 55966532
methyl 4-[(2S)-2-aminopentanoyl]piperazine-1-carboxylate
CID 93469912
2-methylpropyl 4-[2-oxo-2-(propylamino)ethyl]piperazine-1-carboxylate
CID 78803248
2-[4-(2-aminobutanoyl)piperazin-1-yl]-N-methylacetamide
CID 54869276
(2R)-2-amino-1-[4-(3-methylbutyl)piperazin-1-yl]pentan-1-one
CID 93375585
2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-ethylacetamide
CID 54995847
N-propyl-2-pyrrolidin-1-ylacetamide
CID 22117904
2-[4-(2-amino-2-sulfanylideneethyl)piperazin-1-yl]-N-propylacetamide
CID 63336689
2-[4-(2-amino-3-methylbutanoyl)piperazin-1-yl]-N-ethylacetamide
CID 54870603
2-[4-(3-amino-2-methylpropyl)piperazin-1-yl]-N-propylacetamide
CID 43252897
2-[4-(3-chloropropanoyl)piperazin-1-yl]-N-propylacetamide
CID 54874647

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide?
The IUPAC name of 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide (CID 60936804) is 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide.
What is the SMILES notation for 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide?
The canonical SMILES for 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide is CCCNC(=O)CN1CCN(C(=O)C(N)CCC)CC1.
What is the InChIKey of 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide?
The InChIKey is WODWIADULPASBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-3-5-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16-6-4-2/h12H,3-11,15H2,1-2H3,(H,16,19).
What are the key properties of 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide?
2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide has a molecular weight of 284.40 g/mol, XLogP of -0.22, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminopentanoyl)piperazin-1-yl]-N-propylacetamide is sourced from PubChem (CID 60936804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).