2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone

C12H18N4O — CID 82510408

IUPAC2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone
SMILESNNC(C(=O)N1CCNCC1)c1ccccc1
InChIInChI=1S/C12H18N4O/c13-15-11(10-4-2-1-3-5-10)12(17)16-8-6-14-7-9-16/h1-5,11,14-15H,6-9,13H2
InChIKeyJMJPNYOSJNYXNN-UHFFFAOYSA-N
MW234.30 g/mol
LogP-0.38
Rot. Bonds3

About 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone

2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone (PubChem CID 82510408) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone
PubChem CID82510408
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone
SMILESNNC(C(=O)N1CCNCC1)c1ccccc1
InChIInChI=1S/C12H18N4O/c13-15-11(10-4-2-1-3-5-10)12(17)16-8-6-14-7-9-16/h1-5,11,14-15H,6-9,13H2
InChIKeyJMJPNYOSJNYXNN-UHFFFAOYSA-N
XLogP-0.38
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-1-piperazin-1-ylpropan-1-one
CID 52983882
3-methyl-2-phenyl-1-piperazin-1-ylbutan-1-one
CID 82086271
2,3-diphenyl-1-piperazin-1-ylpropan-1-one
CID 57105688
2-(N-phenylanilino)-1-piperazin-1-ylpropan-1-one
CID 10470597
N-(1-phenylethyl)piperazine-1-carboxamide
CID 22011928
N-[(1S)-1-phenylethyl]-1,4,7,10-tetrazacyclododecane-1-carboxamide
CID 102420042
benzhydryl piperazine-1-carboxylate
CID 69141758
(2R)-2-phenyl-2-piperazin-1-ylacetamide
CID 28805503
3-phenyl-1-piperazin-1-yl-2-sulfanylpropan-1-one
CID 82511771
2-hydrazinyl-2-phenylacetyl chloride
CID 55280591
trans-(1R,2R)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-piperazin-1-ylcyclohexane-1-carboxamide;trans-(1S,2S)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-piperazin-1-ylcyclohexane-1-carboxamide
CID 159017930
N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide
CID 119401596

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone?
The IUPAC name of 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone (CID 82510408) is 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone?
The canonical SMILES for 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone is NNC(C(=O)N1CCNCC1)c1ccccc1.
What is the InChIKey of 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone?
The InChIKey is JMJPNYOSJNYXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-15-11(10-4-2-1-3-5-10)12(17)16-8-6-14-7-9-16/h1-5,11,14-15H,6-9,13H2.
What are the key properties of 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone?
2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone has a molecular weight of 234.30 g/mol, XLogP of -0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone is sourced from PubChem (CID 82510408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).