ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate

C14H28N2O2 — CID 19090267

IUPACethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate
SMILESCCNC1CC(C)(C)N(C(=O)OCC)C(C)(C)C1
InChIInChI=1S/C14H28N2O2/c1-7-15-11-9-13(3,4)16(12(17)18-8-2)14(5,6)10-11/h11,15H,7-10H2,1-6H3
InChIKeySHSCCCOWTCLFBT-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.77
Rot. Bonds3

About ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate

ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate (PubChem CID 19090267) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate
PubChem CID19090267
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Nameethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate
SMILESCCNC1CC(C)(C)N(C(=O)OCC)C(C)(C)C1
InChIInChI=1S/C14H28N2O2/c1-7-15-11-9-13(3,4)16(12(17)18-8-2)14(5,6)10-11/h11,15H,7-10H2,1-6H3
InChIKeySHSCCCOWTCLFBT-UHFFFAOYSA-N
XLogP2.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate?
The IUPAC name of ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate (CID 19090267) is ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate?
The canonical SMILES for ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate is CCNC1CC(C)(C)N(C(=O)OCC)C(C)(C)C1.
What is the InChIKey of ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate?
The InChIKey is SHSCCCOWTCLFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-7-15-11-9-13(3,4)16(12(17)18-8-2)14(5,6)10-11/h11,15H,7-10H2,1-6H3.
What are the key properties of ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate?
ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate has a molecular weight of 256.39 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(ethylamino)-2,2,6,6-tetramethylpiperidine-1-carboxylate is sourced from PubChem (CID 19090267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).