propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate

C11H21NO3 — CID 62356607

IUPACpropan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate
SMILESCC(C)OC(=O)N1CCCC(CCO)C1
InChIInChI=1S/C11H21NO3/c1-9(2)15-11(14)12-6-3-4-10(8-12)5-7-13/h9-10,13H,3-8H2,1-2H3
InChIKeyUBMRXHNCDIPEPL-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.63
Rot. Bonds3

About propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate

propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate (PubChem CID 62356607) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate.

Molecular Properties

Compound Namepropan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate
PubChem CID62356607
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Namepropan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate
SMILESCC(C)OC(=O)N1CCCC(CCO)C1
InChIInChI=1S/C11H21NO3/c1-9(2)15-11(14)12-6-3-4-10(8-12)5-7-13/h9-10,13H,3-8H2,1-2H3
InChIKeyUBMRXHNCDIPEPL-UHFFFAOYSA-N
XLogP1.63
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetate
CID 107228466
2-ethoxy-1-[3-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 62372171
(3R)-3-(2-hydroxyethyl)piperidine-1-carboxylic acid
CID 69075758
4-[3-(2-hydroxyethyl)piperidin-1-yl]-2,3-dimethyl-4-oxobutanoic acid
CID 107214215
(3R)-1-propan-2-yloxycarbonylpiperidine-3-carboxylic acid
CID 81119636
propan-2-yl 4-propan-2-ylazepane-1-carboxylate
CID 116656252
3-(2-hydroxyethyl)-N-(2-methylpropyl)piperidine-1-carbothioamide
CID 107227325
3-O-ethyl 1-O-propan-2-yl (3S)-piperidine-1,3-dicarboxylate
CID 115536035
2-ethyl-1-[3-(2-hydroxyethyl)piperidin-1-yl]hexan-1-one
CID 62372858
butyl (3S)-3-(3-hydroxypropyl)piperidine-1-carboxylate
CID 67695311
6-amino-1-[3-(2-hydroxyethyl)piperidin-1-yl]-2-methylheptan-1-one
CID 107217037
2-chloro-1-[3-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 107216511

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate?
The IUPAC name of propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate (CID 62356607) is propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate.
What is the SMILES notation for propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate?
The canonical SMILES for propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate is CC(C)OC(=O)N1CCCC(CCO)C1.
What is the InChIKey of propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate?
The InChIKey is UBMRXHNCDIPEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(2)15-11(14)12-6-3-4-10(8-12)5-7-13/h9-10,13H,3-8H2,1-2H3.
What are the key properties of propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate?
propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate has a molecular weight of 215.29 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 3-(2-hydroxyethyl)piperidine-1-carboxylate is sourced from PubChem (CID 62356607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).