ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium

C9H22N2OV — CID 176984837

IUPACethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium
SMILESCC.CN1CCN(CCO)CC1.[V]
InChIInChI=1S/C7H16N2O.C2H6.V/c1-8-2-4-9(5-3-8)6-7-10;1-2;/h10H,2-7H2,1H3;1-2H3;
InChIKeyYTFZSWFVUXQKGB-UHFFFAOYSA-N
MW225.23 g/mol
LogP0.25
Rot. Bonds2

About ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium

ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium (PubChem CID 176984837) has the molecular formula C9H22N2OV and a molecular weight of 225.23 g/mol. Its IUPAC name is ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium.

Molecular Properties

Compound Nameethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium
PubChem CID176984837
Molecular FormulaC9H22N2OV
Molecular Weight225.23 g/mol
Exact Mass225.12
IUPAC Nameethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium
SMILESCC.CN1CCN(CCO)CC1.[V]
InChIInChI=1S/C7H16N2O.C2H6.V/c1-8-2-4-9(5-3-8)6-7-10;1-2;/h10H,2-7H2,1H3;1-2H3;
InChIKeyYTFZSWFVUXQKGB-UHFFFAOYSA-N
XLogP0.25
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.23
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium?
The IUPAC name of ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium (CID 176984837) is ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium.
What is the SMILES notation for ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium?
The canonical SMILES for ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium is CC.CN1CCN(CCO)CC1.[V].
What is the InChIKey of ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium?
The InChIKey is YTFZSWFVUXQKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O.C2H6.V/c1-8-2-4-9(5-3-8)6-7-10;1-2;/h10H,2-7H2,1H3;1-2H3;.
What are the key properties of ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium?
ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium has a molecular weight of 225.23 g/mol, XLogP of 0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(4-methylpiperazin-1-yl)ethanol;vanadium is sourced from PubChem (CID 176984837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).