2-(piperidin-4-ylamino)ethanol;dihydrochloride

C7H18Cl2N2O — CID 71757509

IUPAC2-(piperidin-4-ylamino)ethanol;dihydrochloride
SMILESCl.Cl.OCCNC1CCNCC1
InChIInChI=1S/C7H16N2O.2ClH/c10-6-5-9-7-1-3-8-4-2-7;;/h7-10H,1-6H2;2*1H
InChIKeyVMGALVRHHOQQPZ-UHFFFAOYSA-N
MW217.14 g/mol
LogP0.16
Rot. Bonds3

About 2-(piperidin-4-ylamino)ethanol;dihydrochloride

2-(piperidin-4-ylamino)ethanol;dihydrochloride (PubChem CID 71757509) has the molecular formula C7H18Cl2N2O and a molecular weight of 217.14 g/mol. Its IUPAC name is 2-(piperidin-4-ylamino)ethanol;dihydrochloride.

Molecular Properties

Compound Name2-(piperidin-4-ylamino)ethanol;dihydrochloride
PubChem CID71757509
Molecular FormulaC7H18Cl2N2O
Molecular Weight217.14 g/mol
Exact Mass216.08
IUPAC Name2-(piperidin-4-ylamino)ethanol;dihydrochloride
SMILESCl.Cl.OCCNC1CCNCC1
InChIInChI=1S/C7H16N2O.2ClH/c10-6-5-9-7-1-3-8-4-2-7;;/h7-10H,1-6H2;2*1H
InChIKeyVMGALVRHHOQQPZ-UHFFFAOYSA-N
XLogP0.16
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.14
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(piperidin-4-ylamino)ethanol;dihydrochloride?
The IUPAC name of 2-(piperidin-4-ylamino)ethanol;dihydrochloride (CID 71757509) is 2-(piperidin-4-ylamino)ethanol;dihydrochloride.
What is the SMILES notation for 2-(piperidin-4-ylamino)ethanol;dihydrochloride?
The canonical SMILES for 2-(piperidin-4-ylamino)ethanol;dihydrochloride is Cl.Cl.OCCNC1CCNCC1.
What is the InChIKey of 2-(piperidin-4-ylamino)ethanol;dihydrochloride?
The InChIKey is VMGALVRHHOQQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O.2ClH/c10-6-5-9-7-1-3-8-4-2-7;;/h7-10H,1-6H2;2*1H.
What are the key properties of 2-(piperidin-4-ylamino)ethanol;dihydrochloride?
2-(piperidin-4-ylamino)ethanol;dihydrochloride has a molecular weight of 217.14 g/mol, XLogP of 0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidin-4-ylamino)ethanol;dihydrochloride is sourced from PubChem (CID 71757509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).