(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride

C8H18ClNO — CID 170912928

IUPAC(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride
SMILESC[C@@H](O)C1CCN(C)CC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-7(10)8-3-5-9(2)6-4-8;/h7-8,10H,3-6H2,1-2H3;1H/t7-;/m1./s1
InChIKeyFCRTVPFVKMRDNI-OGFXRTJISA-N
MW179.69 g/mol
LogP1.13
Rot. Bonds1

About (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride

(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride (PubChem CID 170912928) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride
PubChem CID170912928
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride
SMILESC[C@@H](O)C1CCN(C)CC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-7(10)8-3-5-9(2)6-4-8;/h7-8,10H,3-6H2,1-2H3;1H/t7-;/m1./s1
InChIKeyFCRTVPFVKMRDNI-OGFXRTJISA-N
XLogP1.13
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride?
The IUPAC name of (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride (CID 170912928) is (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride.
What is the SMILES notation for (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride?
The canonical SMILES for (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride is C[C@@H](O)C1CCN(C)CC1.Cl.
What is the InChIKey of (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride?
The InChIKey is FCRTVPFVKMRDNI-OGFXRTJISA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-7(10)8-3-5-9(2)6-4-8;/h7-8,10H,3-6H2,1-2H3;1H/t7-;/m1./s1.
What are the key properties of (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride?
(1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(1-methylpiperidin-4-yl)ethanol;hydrochloride is sourced from PubChem (CID 170912928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).