[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone

C14H26N2O2 — CID 89469188

IUPAC[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
SMILESCN1CCC(C(=O)N2CCCC(CCO)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-15-8-4-13(5-9-15)14(18)16-7-2-3-12(11-16)6-10-17/h12-13,17H,2-11H2,1H3
InChIKeyZDSDNYSLFRCDMB-UHFFFAOYSA-N
MW254.37 g/mol
LogP0.95
Rot. Bonds3

About [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone

[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone (PubChem CID 89469188) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
PubChem CID89469188
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
SMILESCN1CCC(C(=O)N2CCCC(CCO)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-15-8-4-13(5-9-15)14(18)16-7-2-3-12(11-16)6-10-17/h12-13,17H,2-11H2,1H3
InChIKeyZDSDNYSLFRCDMB-UHFFFAOYSA-N
XLogP0.95
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminocyclohexyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107216903
2,3-dihydro-1H-inden-2-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 106703940
[3-(2-chloroethyl)piperidin-1-yl]-cyclobutylmethanone
CID 63395841
[3-(2-aminoethyl)piperidin-1-yl]-cyclobutylmethanone
CID 63766706
cyclohex-3-en-1-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62370931
(3R)-3-(2-hydroxyethyl)piperidine-1-carboxylic acid
CID 69075758
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(4-methylcyclohexyl)methanone
CID 115775330
cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone
CID 176933785
1-[3-[2-[1-(cyclopropanecarbonyl)piperidin-3-yl]ethyl]piperidin-1-yl]-2-methylpropan-1-one
CID 68633970
[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylsulfonylpyrrolidin-2-yl)methanone
CID 62356591
[3-(2-hydroxyethyl)piperidin-1-yl]-(6-methylpiperidin-2-yl)methanone
CID 107227490
[3-(2-hydroxyethyl)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 103855486

Frequently Asked Questions

What is the IUPAC name of [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The IUPAC name of [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone (CID 89469188) is [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone.
What is the SMILES notation for [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The canonical SMILES for [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone is CN1CCC(C(=O)N2CCCC(CCO)C2)CC1.
What is the InChIKey of [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The InChIKey is ZDSDNYSLFRCDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-15-8-4-13(5-9-15)14(18)16-7-2-3-12(11-16)6-10-17/h12-13,17H,2-11H2,1H3.
What are the key properties of [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
[3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone has a molecular weight of 254.37 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-hydroxyethyl)piperidin-1-yl]-(1-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 89469188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).