1-(4-propylpiperazin-1-yl)ethanone;tungsten

C9H17N2OW- — CID 59834183

IUPAC1-(4-propylpiperazin-1-yl)ethanone;tungsten
SMILES[CH2-]C(=O)N1CCN(CCC)CC1.[W]
InChIInChI=1S/C9H17N2O.W/c1-3-4-10-5-7-11(8-6-10)9(2)12;/h2-8H2,1H3;/q-1;
InChIKeyZLKQDFAGSPLEBZ-UHFFFAOYSA-N
MW353.09 g/mol
LogP0.37
Rot. Bonds2

About 1-(4-propylpiperazin-1-yl)ethanone;tungsten

1-(4-propylpiperazin-1-yl)ethanone;tungsten (PubChem CID 59834183) has the molecular formula C9H17N2OW- and a molecular weight of 353.09 g/mol. Its IUPAC name is 1-(4-propylpiperazin-1-yl)ethanone;tungsten.

Molecular Properties

Compound Name1-(4-propylpiperazin-1-yl)ethanone;tungsten
PubChem CID59834183
Molecular FormulaC9H17N2OW-
Molecular Weight353.09 g/mol
Exact Mass353.09
IUPAC Name1-(4-propylpiperazin-1-yl)ethanone;tungsten
SMILES[CH2-]C(=O)N1CCN(CCC)CC1.[W]
InChIInChI=1S/C9H17N2O.W/c1-3-4-10-5-7-11(8-6-10)9(2)12;/h2-8H2,1H3;/q-1;
InChIKeyZLKQDFAGSPLEBZ-UHFFFAOYSA-N
XLogP0.37
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.09
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

1-(aziridin-1-yl)-2-(4-propylpiperazin-1-yl)ethanone
CID 89072510
4-propylpiperazine-1-carboxamide
CID 16792615
ethane;1-(4-propylpiperazin-1-yl)propan-1-one
CID 171788369
2-[4,7-bis(carboxylatomethyl)-10-propyl-1,4,7,10-tetrazacyclododec-1-yl]acetate
CID 21301798
1-[4-[(4-propylpiperazin-1-yl)methyl]piperazin-1-yl]propan-1-one
CID 178000242
N-propan-2-yl-4-propylpiperazine-1-carboxamide
CID 17185062
2-ethoxy-1-(4-propylpiperazin-1-yl)ethanone
CID 60708281
2-[(4-propylpiperazine-1-carbonyl)amino]propanoic acid
CID 61188565
2-(4-propylpiperazine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 60792822
(4-propylpiperazin-1-yl)-(4-propylpiperidin-4-yl)methanone
CID 63127821
3-(4-propylpiperazine-1-carbonyl)benzoic acid
CID 43452662
(4-amino-3-pyridinyl)-(4-propylpiperazin-1-yl)methanone
CID 81236290

Frequently Asked Questions

What is the IUPAC name of 1-(4-propylpiperazin-1-yl)ethanone;tungsten?
The IUPAC name of 1-(4-propylpiperazin-1-yl)ethanone;tungsten (CID 59834183) is 1-(4-propylpiperazin-1-yl)ethanone;tungsten.
What is the SMILES notation for 1-(4-propylpiperazin-1-yl)ethanone;tungsten?
The canonical SMILES for 1-(4-propylpiperazin-1-yl)ethanone;tungsten is [CH2-]C(=O)N1CCN(CCC)CC1.[W].
What is the InChIKey of 1-(4-propylpiperazin-1-yl)ethanone;tungsten?
The InChIKey is ZLKQDFAGSPLEBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N2O.W/c1-3-4-10-5-7-11(8-6-10)9(2)12;/h2-8H2,1H3;/q-1;.
What are the key properties of 1-(4-propylpiperazin-1-yl)ethanone;tungsten?
1-(4-propylpiperazin-1-yl)ethanone;tungsten has a molecular weight of 353.09 g/mol, XLogP of 0.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylpiperazin-1-yl)ethanone;tungsten is sourced from PubChem (CID 59834183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).