tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate

C14H26N2O3 — CID 14571198

IUPACtert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C14H26N2O3/c1-14(2,3)19-13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15/h12H,4-11H2,1-3H3
InChIKeyJBWQUSZFCONMDT-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.72
Rot. Bonds1

About tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate

tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate (PubChem CID 14571198) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate
PubChem CID14571198
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Nametert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C14H26N2O3/c1-14(2,3)19-13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15/h12H,4-11H2,1-3H3
InChIKeyJBWQUSZFCONMDT-UHFFFAOYSA-N
XLogP1.72
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate (CID 14571198) is tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate?
The InChIKey is JBWQUSZFCONMDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-14(2,3)19-13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15/h12H,4-11H2,1-3H3.
What are the key properties of tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate?
tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate has a molecular weight of 270.37 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-morpholin-4-ylpiperidine-1-carboxylate is sourced from PubChem (CID 14571198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).