(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol

C15H23NO2 — CID 82297068

IUPAC(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol
SMILESCCc1cc(C(O)C2CCNCC2)ccc1OC
InChIInChI=1S/C15H23NO2/c1-3-11-10-13(4-5-14(11)18-2)15(17)12-6-8-16-9-7-12/h4-5,10,12,15-17H,3,6-9H2,1-2H3
InChIKeyHHVRIHCROSOTMZ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.29
Rot. Bonds4

About (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol

(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol (PubChem CID 82297068) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol.

Molecular Properties

Compound Name(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol
PubChem CID82297068
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol
SMILESCCc1cc(C(O)C2CCNCC2)ccc1OC
InChIInChI=1S/C15H23NO2/c1-3-11-10-13(4-5-14(11)18-2)15(17)12-6-8-16-9-7-12/h4-5,10,12,15-17H,3,6-9H2,1-2H3
InChIKeyHHVRIHCROSOTMZ-UHFFFAOYSA-N
XLogP2.29
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-4-methoxyphenyl)ethane-1,2-diol
CID 82281977
1-(3-ethyl-4-methoxyphenyl)ethanol
CID 83529963
(3-ethyl-4-methoxyphenyl)-piperazin-1-ylmethanamine
CID 116939767
[4-(4-methoxyphenyl)phenyl]-piperidin-4-ylmethanol
CID 82341647
2-(3,4-dimethoxyphenyl)-2-piperidin-4-ylethanol
CID 116825142
(R)-(3-ethoxy-4-methoxyphenyl)-piperidin-4-ylmethanamine
CID 171314559
2-(3-ethyl-4-methoxyphenyl)-2-(methylamino)acetic acid
CID 82473167
methyl 2-(3-ethyl-4-methoxyphenyl)-2-(methylamino)acetate
CID 116856998
4-(difluoromethyl)-2-ethyl-1-methoxybenzene
CID 176934725
(2,4-dimethoxyphenyl)-piperidin-4-ylmethanol
CID 79024060
(3,4-difluorophenyl)-piperidin-4-ylmethanol
CID 43146486
(3-tert-butyl-4-methoxyphenyl)-cyclopropylmethanol
CID 82049131

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol?
The IUPAC name of (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol (CID 82297068) is (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol.
What is the SMILES notation for (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol?
The canonical SMILES for (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol is CCc1cc(C(O)C2CCNCC2)ccc1OC.
What is the InChIKey of (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol?
The InChIKey is HHVRIHCROSOTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-11-10-13(4-5-14(11)18-2)15(17)12-6-8-16-9-7-12/h4-5,10,12,15-17H,3,6-9H2,1-2H3.
What are the key properties of (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol?
(3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol has a molecular weight of 249.35 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-4-methoxyphenyl)-piperidin-4-ylmethanol is sourced from PubChem (CID 82297068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).