N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide

C12H23N3O2 — CID 131930077

IUPACN-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide
SMILESCCN(CCN1CCOCC1)C(=O)C1CCN1
InChIInChI=1S/C12H23N3O2/c1-2-15(12(16)11-3-4-13-11)6-5-14-7-9-17-10-8-14/h11,13H,2-10H2,1H3
InChIKeyWBBYGUWVGYJEKJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.47
Rot. Bonds5

About N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide

N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide (PubChem CID 131930077) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide
PubChem CID131930077
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide
SMILESCCN(CCN1CCOCC1)C(=O)C1CCN1
InChIInChI=1S/C12H23N3O2/c1-2-15(12(16)11-3-4-13-11)6-5-14-7-9-17-10-8-14/h11,13H,2-10H2,1H3
InChIKeyWBBYGUWVGYJEKJ-UHFFFAOYSA-N
XLogP-0.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide?
The IUPAC name of N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide (CID 131930077) is N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide?
The canonical SMILES for N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide is CCN(CCN1CCOCC1)C(=O)C1CCN1.
What is the InChIKey of N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide?
The InChIKey is WBBYGUWVGYJEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-2-15(12(16)11-3-4-13-11)6-5-14-7-9-17-10-8-14/h11,13H,2-10H2,1H3.
What are the key properties of N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide?
N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-morpholin-4-ylethyl)azetidine-2-carboxamide is sourced from PubChem (CID 131930077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).