N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide

C14H28N4O2 — CID 62837069

IUPACN-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide
SMILESCCNC(=O)CN1CCN(C(=O)CC(C)NCC)CC1
InChIInChI=1S/C14H28N4O2/c1-4-15-12(3)10-14(20)18-8-6-17(7-9-18)11-13(19)16-5-2/h12,15H,4-11H2,1-3H3,(H,16,19)
InChIKeyLPYIQTPNNRJPGE-UHFFFAOYSA-N
MW284.40 g/mol
LogP-0.35
Rot. Bonds7

About N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide

N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide (PubChem CID 62837069) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide
PubChem CID62837069
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC NameN-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide
SMILESCCNC(=O)CN1CCN(C(=O)CC(C)NCC)CC1
InChIInChI=1S/C14H28N4O2/c1-4-15-12(3)10-14(20)18-8-6-17(7-9-18)11-13(19)16-5-2/h12,15H,4-11H2,1-3H3,(H,16,19)
InChIKeyLPYIQTPNNRJPGE-UHFFFAOYSA-N
XLogP-0.35
TPSA64.68 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 ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(3-aminobutanoyl)-1,4-diazepan-1-yl]-N-ethylacetamide
CID 120872775
3-(ethylamino)-1-[4-(3-methylbutyl)piperazin-1-yl]butan-1-one
CID 55121642
3-(ethylamino)-1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butan-1-one
CID 62838357
2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-ethylacetamide
CID 54995847
N-ethyl-2-[4-[3-(ethylamino)propanoyl]piperazin-1-yl]acetamide
CID 62834367
N-ethyl-2-[4-[2-(2,2,2-trifluoroethylamino)acetyl]piperazin-1-yl]acetamide
CID 78924430
2-[4-(2-amino-3-methylbutanoyl)piperazin-1-yl]-N-ethylacetamide
CID 54870603
2-[4-(4-chlorobutanoyl)piperazin-1-yl]-N-ethylacetamide
CID 63307721
4-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-2,3-dimethyl-4-oxobutanoic acid
CID 103497635
2-[4-(3-amino-3-phenylpropanoyl)piperazin-1-yl]-N-ethylacetamide;dihydrochloride
CID 119952990
1-[3-(ethylamino)butanoyl]piperidine-4-carboxylic acid
CID 62837825
2-(azetidin-1-yl)-N-ethylacetamide
CID 129266397

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide?
The IUPAC name of N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide (CID 62837069) is N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide is CCNC(=O)CN1CCN(C(=O)CC(C)NCC)CC1.
What is the InChIKey of N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide?
The InChIKey is LPYIQTPNNRJPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-4-15-12(3)10-14(20)18-8-6-17(7-9-18)11-13(19)16-5-2/h12,15H,4-11H2,1-3H3,(H,16,19).
What are the key properties of N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide?
N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide has a molecular weight of 284.40 g/mol, XLogP of -0.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-[3-(ethylamino)butanoyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 62837069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).