(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol

C14H22NO2+ — CID 7348196

IUPAC(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol
SMILESCCOc1ccc([C@H](O)C2CC[NH2+]CC2)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14(16)12-7-9-15-10-8-12/h3-6,12,14-16H,2,7-10H2,1H3/p+1/t14-/m0/s1
InChIKeyAWTYXPOFKMCTJJ-AWEZNQCLSA-O
MW236.34 g/mol
LogP1.09
Rot. Bonds4

About (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol

(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol (PubChem CID 7348196) has the molecular formula C14H22NO2+ and a molecular weight of 236.34 g/mol. Its IUPAC name is (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol.

Molecular Properties

Compound Name(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol
PubChem CID7348196
Molecular FormulaC14H22NO2+
Molecular Weight236.34 g/mol
Exact Mass236.16
IUPAC Name(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol
SMILESCCOc1ccc([C@H](O)C2CC[NH2+]CC2)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14(16)12-7-9-15-10-8-12/h3-6,12,14-16H,2,7-10H2,1H3/p+1/t14-/m0/s1
InChIKeyAWTYXPOFKMCTJJ-AWEZNQCLSA-O
XLogP1.09
TPSA46.07 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 61101248
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(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
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3-amino-1-cyclopropyl-2-(4-ethoxyphenyl)propan-1-ol
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(4-ethoxyphenyl)-[2-(trifluoromethyl)cyclohexyl]methanol
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4-[amino-(4-ethoxyphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937243
cyclopropyl-[4-[(4-methoxyphenyl)methoxy]phenyl]methanol
CID 6482546
(4-ethylcyclohexyl)-(4-methoxyphenyl)methanol
CID 64749359
(4-ethoxyphenyl)-(4-propylcyclohexyl)methanamine
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amino-(4-ethoxyphenyl)methanol
CID 116939610
cyclobutyl-(4-cyclopropyloxyphenyl)methanol
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Frequently Asked Questions

What is the IUPAC name of (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol?
The IUPAC name of (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol (CID 7348196) is (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol.
What is the SMILES notation for (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol?
The canonical SMILES for (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol is CCOc1ccc([C@H](O)C2CC[NH2+]CC2)cc1.
What is the InChIKey of (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol?
The InChIKey is AWTYXPOFKMCTJJ-AWEZNQCLSA-O. The full InChI is InChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14(16)12-7-9-15-10-8-12/h3-6,12,14-16H,2,7-10H2,1H3/p+1/t14-/m0/s1.
What are the key properties of (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol?
(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol has a molecular weight of 236.34 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol is sourced from PubChem (CID 7348196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).