N-ethyl-2-piperazin-1-ylpropanamide

C9H19N3O — CID 13340427

IUPACN-ethyl-2-piperazin-1-ylpropanamide
SMILESCCNC(=O)C(C)N1CCNCC1
InChIInChI=1S/C9H19N3O/c1-3-11-9(13)8(2)12-6-4-10-5-7-12/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyVJXUDQAHKKFTBL-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.58
Rot. Bonds3

About N-ethyl-2-piperazin-1-ylpropanamide

N-ethyl-2-piperazin-1-ylpropanamide (PubChem CID 13340427) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N-ethyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-piperazin-1-ylpropanamide
PubChem CID13340427
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN-ethyl-2-piperazin-1-ylpropanamide
SMILESCCNC(=O)C(C)N1CCNCC1
InChIInChI=1S/C9H19N3O/c1-3-11-9(13)8(2)12-6-4-10-5-7-12/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyVJXUDQAHKKFTBL-UHFFFAOYSA-N
XLogP-0.58
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-Dimethylpiperazine-2,5-dione
CID 97704
2-Piperazinone, 3,3-dimethyl-
CID 211157
Cyclo(alanyl-glycyl)
CID 107297
Cyclo(alanylalanyl)
CID 165356
N,N-dimethyl-2-(piperazin-1-yl)acetamide
CID 2758642
N-isopropyl-1-piperazineacetamide
CID 100826
L-Alanylglycinamide
CID 7019037
N-[2-(4-propanoylpiperazin-1-yl)ethyl]propanamide
CID 718529
(3S,6S)-3,6-Diisopropylpiperazine-2,5-dione
CID 7075896
Alanine anhydride, trans-(A+-)-
CID 676438
D-Alanine anhydride
CID 676439
1-(Piperazin-1-yl)propan-1-one
CID 3844375

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-ethyl-2-piperazin-1-ylpropanamide (CID 13340427) is N-ethyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-ethyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-ethyl-2-piperazin-1-ylpropanamide is CCNC(=O)C(C)N1CCNCC1.
What is the InChIKey of N-ethyl-2-piperazin-1-ylpropanamide?
The InChIKey is VJXUDQAHKKFTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-3-11-9(13)8(2)12-6-4-10-5-7-12/h8,10H,3-7H2,1-2H3,(H,11,13).
What are the key properties of N-ethyl-2-piperazin-1-ylpropanamide?
N-ethyl-2-piperazin-1-ylpropanamide has a molecular weight of 185.27 g/mol, XLogP of -0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 13340427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).