tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate

C10H20N2O3 — CID 67130180

IUPACtert-butyl N-(4-hydroxypiperidin-3-yl)carbamate
SMILESCC(C)(C)OC(=O)NC1CNCCC1O
InChIInChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-7-6-11-5-4-8(7)13/h7-8,11,13H,4-6H2,1-3H3,(H,12,14)
InChIKeyREUNVCLBHFFYFH-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.23
Rot. Bonds1

About tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate

tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate (PubChem CID 67130180) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(4-hydroxypiperidin-3-yl)carbamate
PubChem CID67130180
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Nametert-butyl N-(4-hydroxypiperidin-3-yl)carbamate
SMILESCC(C)(C)OC(=O)NC1CNCCC1O
InChIInChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-7-6-11-5-4-8(7)13/h7-8,11,13H,4-6H2,1-3H3,(H,12,14)
InChIKeyREUNVCLBHFFYFH-UHFFFAOYSA-N
XLogP0.23
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate?
The IUPAC name of tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate (CID 67130180) is tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate.
What is the SMILES notation for tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate?
The canonical SMILES for tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate is CC(C)(C)OC(=O)NC1CNCCC1O.
What is the InChIKey of tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate?
The InChIKey is REUNVCLBHFFYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-7-6-11-5-4-8(7)13/h7-8,11,13H,4-6H2,1-3H3,(H,12,14).
What are the key properties of tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate?
tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate has a molecular weight of 216.28 g/mol, XLogP of 0.23, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(4-hydroxypiperidin-3-yl)carbamate is sourced from PubChem (CID 67130180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).