N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide

C14H29N3O2 — CID 70881584

IUPACN-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide
SMILESCCN(CCNC)C(=O)C1CC(C)(C)N(O)C1(C)C
InChIInChI=1S/C14H29N3O2/c1-7-16(9-8-15-6)12(18)11-10-13(2,3)17(19)14(11,4)5/h11,15,19H,7-10H2,1-6H3
InChIKeyUBICONJJHJMFOO-UHFFFAOYSA-N
MW271.40 g/mol
LogP1.32
Rot. Bonds5

About N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide

N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide (PubChem CID 70881584) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide
PubChem CID70881584
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC NameN-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide
SMILESCCN(CCNC)C(=O)C1CC(C)(C)N(O)C1(C)C
InChIInChI=1S/C14H29N3O2/c1-7-16(9-8-15-6)12(18)11-10-13(2,3)17(19)14(11,4)5/h11,15,19H,7-10H2,1-6H3
InChIKeyUBICONJJHJMFOO-UHFFFAOYSA-N
XLogP1.32
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide (CID 70881584) is N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide is CCN(CCNC)C(=O)C1CC(C)(C)N(O)C1(C)C.
What is the InChIKey of N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide?
The InChIKey is UBICONJJHJMFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-7-16(9-8-15-6)12(18)11-10-13(2,3)17(19)14(11,4)5/h11,15,19H,7-10H2,1-6H3.
What are the key properties of N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide?
N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide has a molecular weight of 271.40 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-hydroxy-2,2,5,5-tetramethyl-N-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 70881584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).