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

Rhodotorulic acid
CID 688571
Fasoracetam
CID 198695
Cyclo(glycyl-L-leucyl)
CID 927723
Cyclo(L-leucyl-L-leucyl)
CID 192731
Cyclo(leucylglycine)
CID 2902
3-Methyl-octahydropyrrolo(1,2-a)piperazine-1,4-dione
CID 6428987
(3S)-3-aminopiperidin-2-one
CID 7200369
Cyclo(alanyl-leucyl)
CID 13879946
3-Amino-2-piperidone
CID 5200225
(3S)-4-oxo-4-piperidin-1-ylbutane-1,3-diamine
CID 9942336
(2S)-aminobutyryl-L-proline n-butylamide
CID 11514390
(2S)-aminobutyryl-L-proline n-pentylamide
CID 11615987

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).