1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride

C13H27ClN2O — CID 119931316

IUPAC1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride
SMILESCC(O)C1CCN(CC2CCNCC2)CC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-11(16)13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;/h11-14,16H,2-10H2,1H3;1H
InChIKeyZFXKPEJQWFGFQW-UHFFFAOYSA-N
MW262.82 g/mol
LogP1.50
Rot. Bonds3

About 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride

1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride (PubChem CID 119931316) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride.

Molecular Properties

Compound Name1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride
PubChem CID119931316
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC Name1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride
SMILESCC(O)C1CCN(CC2CCNCC2)CC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-11(16)13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;/h11-14,16H,2-10H2,1H3;1H
InChIKeyZFXKPEJQWFGFQW-UHFFFAOYSA-N
XLogP1.50
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
4-(3-methylbutyl)-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119932466
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-piperidin-4-ylethanone
CID 103810262
1-(1-ethylpiperidin-4-yl)ethanol
CID 588327
[1-(piperidin-4-ylmethyl)pyrrolidin-3-yl]methanol
CID 112629419
4-methyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119930987
2-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxyethanol;hydrochloride
CID 120851709
4-[(3-propan-2-yloxypyrrolidin-1-yl)methyl]piperidine
CID 165136671
1-ethylsulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119930045
N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
CID 156720132
1-ethyl-4-[(4-piperidin-4-ylpiperidin-1-yl)methyl]piperidine
CID 167091278

Frequently Asked Questions

What is the IUPAC name of 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride?
The IUPAC name of 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride (CID 119931316) is 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride.
What is the SMILES notation for 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride?
The canonical SMILES for 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride is CC(O)C1CCN(CC2CCNCC2)CC1.Cl.
What is the InChIKey of 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride?
The InChIKey is ZFXKPEJQWFGFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-11(16)13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;/h11-14,16H,2-10H2,1H3;1H.
What are the key properties of 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride?
1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride is sourced from PubChem (CID 119931316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).