N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide

C11H22N2O2 — CID 65151974

IUPACN-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide
SMILESCC1OC(C)C(C(=O)N(C)CCN)C1C
InChIInChI=1S/C11H22N2O2/c1-7-8(2)15-9(3)10(7)11(14)13(4)6-5-12/h7-10H,5-6,12H2,1-4H3
InChIKeyLJZGZTKCEVCXKU-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.46
Rot. Bonds3

About N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide

N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide (PubChem CID 65151974) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide
PubChem CID65151974
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide
SMILESCC1OC(C)C(C(=O)N(C)CCN)C1C
InChIInChI=1S/C11H22N2O2/c1-7-8(2)15-9(3)10(7)11(14)13(4)6-5-12/h7-10H,5-6,12H2,1-4H3
InChIKeyLJZGZTKCEVCXKU-UHFFFAOYSA-N
XLogP0.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide (CID 65151974) is N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide is CC1OC(C)C(C(=O)N(C)CCN)C1C.
What is the InChIKey of N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide?
The InChIKey is LJZGZTKCEVCXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-7-8(2)15-9(3)10(7)11(14)13(4)6-5-12/h7-10H,5-6,12H2,1-4H3.
What are the key properties of N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide?
N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N,2,4,5-tetramethyloxolane-3-carboxamide is sourced from PubChem (CID 65151974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).