N-cyclopropyl-2-piperazin-1-ylacetamide

C9H17N3O — CID 4962600

IUPACN-cyclopropyl-2-piperazin-1-ylacetamide
SMILESO=C(CN1CCNCC1)NC1CC1
InChIInChI=1S/C9H17N3O/c13-9(11-8-1-2-8)7-12-5-3-10-4-6-12/h8,10H,1-7H2,(H,11,13)
InChIKeyPSGKMZFJVPGLJH-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.83
Rot. Bonds3

About N-cyclopropyl-2-piperazin-1-ylacetamide

N-cyclopropyl-2-piperazin-1-ylacetamide (PubChem CID 4962600) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-cyclopropyl-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-piperazin-1-ylacetamide
PubChem CID4962600
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-cyclopropyl-2-piperazin-1-ylacetamide
SMILESO=C(CN1CCNCC1)NC1CC1
InChIInChI=1S/C9H17N3O/c13-9(11-8-1-2-8)7-12-5-3-10-4-6-12/h8,10H,1-7H2,(H,11,13)
InChIKeyPSGKMZFJVPGLJH-UHFFFAOYSA-N
XLogP-0.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-isopropyl-1-piperazineacetamide
CID 100826
2-[(3R)-3-methylpiperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 91826688
(3R)-3-methylpiperazin-2-one
CID 16213757
N-butyl-2-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-N-propylacetamide
CID 49853581
N-butyl-2-piperazin-1-yl-N-propylacetamide
CID 49853676
N-(pentan-3-yl)-2-(4-propanoylpiperazin-1-yl)acetamide
CID 49853777
3-Methyl-2-ketopiperazine
CID 5106600
N,N-diethyl-2-(piperazin-1-yl)acetamide
CID 7131630
3,5,6-Trimethylpiperazin-2-one
CID 13125044
(S)-3-Methyl-2-ketopiperazine
CID 13190462
6-Methylpiperazin-2-one
CID 13190463
1-(Propan-2-yl)piperazin-2-one
CID 15057401

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-piperazin-1-ylacetamide?
The IUPAC name of N-cyclopropyl-2-piperazin-1-ylacetamide (CID 4962600) is N-cyclopropyl-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-cyclopropyl-2-piperazin-1-ylacetamide?
The canonical SMILES for N-cyclopropyl-2-piperazin-1-ylacetamide is O=C(CN1CCNCC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-piperazin-1-ylacetamide?
The InChIKey is PSGKMZFJVPGLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c13-9(11-8-1-2-8)7-12-5-3-10-4-6-12/h8,10H,1-7H2,(H,11,13).
What are the key properties of N-cyclopropyl-2-piperazin-1-ylacetamide?
N-cyclopropyl-2-piperazin-1-ylacetamide has a molecular weight of 183.25 g/mol, XLogP of -0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-piperazin-1-ylacetamide is sourced from PubChem (CID 4962600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).