tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate

C15H26N2O4 — CID 3238778

IUPACtert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H26N2O4/c1-15(2,3)21-14(19)17-6-4-12(5-7-17)13(18)16-8-10-20-11-9-16/h12H,4-11H2,1-3H3
InChIKeyHJJYSHCBPPLTRG-UHFFFAOYSA-N
MW298.38 g/mol
LogP1.49
Rot. Bonds1

About tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate

tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate (PubChem CID 3238778) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate
PubChem CID3238778
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Nametert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H26N2O4/c1-15(2,3)21-14(19)17-6-4-12(5-7-17)13(18)16-8-10-20-11-9-16/h12H,4-11H2,1-3H3
InChIKeyHJJYSHCBPPLTRG-UHFFFAOYSA-N
XLogP1.49
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[9-(Cyclopropanecarbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]ethanone
CID 95043244
Tert-butyl 4-(piperidine-1-carbonyl)piperidine-1-carboxylate
CID 5017254
Cambridge id 6578647
CID 883920
1-[4-(Morpholin-4-ylcarbonyl)piperidin-1-yl]butan-1-one
CID 45596639
Tert-butyl 3-[2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-2-oxoethyl]azetidine-1-carboxylate
CID 72113053
Tert-butyl 4-(2,2,2-trifluoroacetyl)-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
CID 57989171
Tert-butyl 4-fluoro-4-(morpholin-4-ylmethyl)piperidine-1-carboxylate
CID 121290195
Tert-butyl 4-(4-oxa-7-azaspiro[2.5]octane-7-carbonyl)-4-(trifluoromethyl)piperidine-1-carboxylate
CID 170621571
tert-butyl 4-(trifluoromethyl)-4-[(2S)-2-(trifluoromethyl)morpholine-4-carbonyl]piperidine-1-carboxylate
CID 176759476
tert-butyl 4-(trifluoromethyl)-4-[(2R)-2-(trifluoromethyl)morpholine-4-carbonyl]piperidine-1-carboxylate
CID 176759513
Tert-butyl 4-(4-methylpiperidine-1-carbonyl)piperidine-1-carboxylate
CID 3342289
1-(4-(Morpholinomethyl)piperidin-1-yl)ethanone
CID 60773960

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate (CID 3238778) is tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate?
The InChIKey is HJJYSHCBPPLTRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c1-15(2,3)21-14(19)17-6-4-12(5-7-17)13(18)16-8-10-20-11-9-16/h12H,4-11H2,1-3H3.
What are the key properties of tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate?
tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate has a molecular weight of 298.38 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-(morpholine-4-carbonyl)piperidine-1-carboxylate is sourced from PubChem (CID 3238778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).