tert-butyl 2-hydroxypiperidine-1-carboxylate

C10H19NO3 — CID 10655694

IUPACtert-butyl 2-hydroxypiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCCCC1O
InChIInChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h8,12H,4-7H2,1-3H3
InChIKeyZBCXTNPVDVWHNC-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.73
Rot. Bonds

About tert-butyl 2-hydroxypiperidine-1-carboxylate

tert-butyl 2-hydroxypiperidine-1-carboxylate (PubChem CID 10655694) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is tert-butyl 2-hydroxypiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 2-hydroxypiperidine-1-carboxylate
PubChem CID10655694
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nametert-butyl 2-hydroxypiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCCCC1O
InChIInChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h8,12H,4-7H2,1-3H3
InChIKeyZBCXTNPVDVWHNC-UHFFFAOYSA-N
XLogP1.73
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 2-methylpiperidine-1-carboxylate;ethane
CID 153328823
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 688617
(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 10537428
(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 10704682
tert-butyl 2-methoxypiperidine-1-carboxylate
CID 11424460
tert-butyl (5aR,9aR)-2,3,4,5,5a,6,7,8,9,9a-decahydrobenzo[b]azepine-1-carboxylate
CID 178143547
tert-butyl (2S)-2-(2-methylprop-1-enyl)piperidine-1-carboxylate
CID 45276350
1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid
CID 3292084
tert-butyl 2-(dihydroxymethyl)piperidine-1-carboxylate
CID 140989424
tert-butyl 2-formylpiperidine-1-carboxylate;ethane
CID 145071320
tert-butyl (2R)-2-cyanopiperidine-1-carboxylate
CID 7019482
tert-butyl (2R)-2-ethylpiperidine-1-carboxylate
CID 45095102

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-hydroxypiperidine-1-carboxylate?
The IUPAC name of tert-butyl 2-hydroxypiperidine-1-carboxylate (CID 10655694) is tert-butyl 2-hydroxypiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 2-hydroxypiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 2-hydroxypiperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCCCC1O.
What is the InChIKey of tert-butyl 2-hydroxypiperidine-1-carboxylate?
The InChIKey is ZBCXTNPVDVWHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h8,12H,4-7H2,1-3H3.
What are the key properties of tert-butyl 2-hydroxypiperidine-1-carboxylate?
tert-butyl 2-hydroxypiperidine-1-carboxylate has a molecular weight of 201.27 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-hydroxypiperidine-1-carboxylate is sourced from PubChem (CID 10655694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).