ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol

C11H24N2O — CID 142175203

IUPACethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol
SMILESCC.[H]/N=C(\C)N1CCC(CCO)CC1
InChIInChI=1S/C9H18N2O.C2H6/c1-8(10)11-5-2-9(3-6-11)4-7-12;1-2/h9-10,12H,2-7H2,1H3;1-2H3/b10-8+;
InChIKeyOQUXWJIYQOFOOG-VRTOBVRTSA-N
MW200.33 g/mol
LogP2.10
Rot. Bonds2

About ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol

ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol (PubChem CID 142175203) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol.

Molecular Properties

Compound Nameethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol
PubChem CID142175203
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Nameethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol
SMILESCC.[H]/N=C(\C)N1CCC(CCO)CC1
InChIInChI=1S/C9H18N2O.C2H6/c1-8(10)11-5-2-9(3-6-11)4-7-12;1-2/h9-10,12H,2-7H2,1H3;1-2H3/b10-8+;
InChIKeyOQUXWJIYQOFOOG-VRTOBVRTSA-N
XLogP2.10
TPSA47.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-(2-Hydroxyethyl)piperidine-1-carboximidamide
CID 3056393
2-Imino-2-(4-methylpiperidin-1-yl)ethanol
CID 20637111
3-Imino-3-(4-methylpiperidin-1-yl)propan-1-ol
CID 20637163
2-(1-Octanimidoylpiperidin-4-yl)propan-1-ol
CID 53794051
2-[1-(4-Methylpentanimidoyl)piperidin-4-yl]propan-1-ol
CID 54154578
(1-Ethanimidoylpiperidin-4-yl)methanol
CID 59020702
2-(1-Ethanimidoylpiperidin-3-yl)ethanol
CID 59020818
2-(1-Ethanimidoylpiperidin-4-yl)ethanol
CID 59020836
(1-Ethanimidoylpiperidin-3-yl)methanol
CID 60085645
2-[1-(4-Methylpentanimidoyl)piperidin-4-yl]propan-1-ol;hydrochloride
CID 67741134
2-(1-Octanimidoylpiperidin-4-yl)propan-1-ol;hydrochloride
CID 67741160
2-(1-Ethanimidoylpiperidin-4-yl)propane-1,3-diol
CID 89316583

Frequently Asked Questions

What is the IUPAC name of ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol?
The IUPAC name of ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol (CID 142175203) is ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol.
What is the SMILES notation for ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol?
The canonical SMILES for ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol is CC.[H]/N=C(\C)N1CCC(CCO)CC1.
What is the InChIKey of ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol?
The InChIKey is OQUXWJIYQOFOOG-VRTOBVRTSA-N. The full InChI is InChI=1S/C9H18N2O.C2H6/c1-8(10)11-5-2-9(3-6-11)4-7-12;1-2/h9-10,12H,2-7H2,1H3;1-2H3/b10-8+;.
What are the key properties of ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol?
ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol has a molecular weight of 200.33 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol is sourced from PubChem (CID 142175203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).