[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol

C15H23NO2 — CID 82087200

IUPAC[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol
SMILESCCOc1ccc(C2(CO)CCN(C)CC2)cc1
InChIInChI=1S/C15H23NO2/c1-3-18-14-6-4-13(5-7-14)15(12-17)8-10-16(2)11-9-15/h4-7,17H,3,8-12H2,1-2H3
InChIKeyHXNNLMMMXQSMLH-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.04
Rot. Bonds4

About [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol

[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol (PubChem CID 82087200) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol
PubChem CID82087200
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol
SMILESCCOc1ccc(C2(CO)CCN(C)CC2)cc1
InChIInChI=1S/C15H23NO2/c1-3-18-14-6-4-13(5-7-14)15(12-17)8-10-16(2)11-9-15/h4-7,17H,3,8-12H2,1-2H3
InChIKeyHXNNLMMMXQSMLH-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(4-ethoxyphenyl)spiro[2.3]hexan-5-yl]methanamine
CID 65008279
1-[[1-(4-ethoxyphenyl)cyclopropyl]methyl]piperazine
CID 94692817
(4-ethoxyphenyl)-(4-methylpiperazin-1-yl)methanethione
CID 892521
4-[4-(4-ethoxyphenyl)phenyl]-4-hydroxypiperidine-1-carboxylic acid
CID 67084559
[1-(4-ethoxyphenyl)-3-(methylamino)pyrrolidin-3-yl]methanol
CID 117012337
[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol
CID 116928851
1-(4-ethoxyphenyl)cycloheptane-1-carboxylic acid
CID 28937797
3-[4-(4-ethoxyphenyl)-4-phenylpiperidin-1-yl]propan-1-amine
CID 139833037
2-[4-(3-ethoxyphenyl)-1-methylpiperidin-4-yl]propan-2-ol
CID 13363439
1-(4-ethoxyphenyl)-2,2-dimethylcyclopropan-1-amine
CID 83701496
[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol
CID 81358295
N-[[(3R)-1,3-dimethylpyrrolidin-3-yl]methyl]-1-(4-ethoxyphenyl)-N-methylmethanamine
CID 95135578

Frequently Asked Questions

What is the IUPAC name of [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol?
The IUPAC name of [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol (CID 82087200) is [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol.
What is the SMILES notation for [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol?
The canonical SMILES for [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol is CCOc1ccc(C2(CO)CCN(C)CC2)cc1.
What is the InChIKey of [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol?
The InChIKey is HXNNLMMMXQSMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-18-14-6-4-13(5-7-14)15(12-17)8-10-16(2)11-9-15/h4-7,17H,3,8-12H2,1-2H3.
What are the key properties of [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol?
[4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol has a molecular weight of 249.35 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethoxyphenyl)-1-methylpiperidin-4-yl]methanol is sourced from PubChem (CID 82087200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).