tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate

C10H20N2O3 — CID 69315313

IUPACtert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(N)CC1O
InChIInChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-7(11)6-8(12)13/h7-8,13H,4-6,11H2,1-3H3
InChIKeyHZBJUTMRQCJHBI-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.66
Rot. Bonds

About tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate

tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate (PubChem CID 69315313) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate
PubChem CID69315313
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Nametert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(N)CC1O
InChIInChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-7(11)6-8(12)13/h7-8,13H,4-6,11H2,1-3H3
InChIKeyHZBJUTMRQCJHBI-UHFFFAOYSA-N
XLogP0.66
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate (CID 69315313) is tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(N)CC1O.
What is the InChIKey of tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate?
The InChIKey is HZBJUTMRQCJHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-7(11)6-8(12)13/h7-8,13H,4-6,11H2,1-3H3.
What are the key properties of tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate?
tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate has a molecular weight of 216.28 g/mol, XLogP of 0.66, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-amino-2-hydroxypiperidine-1-carboxylate is sourced from PubChem (CID 69315313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).