3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide

C18H27N3O2 — CID 138045017

IUPAC3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide
SMILESCCC1(c2ccccc2)CN(C(=O)NCCN2CCOCC2)C1
InChIInChI=1S/C18H27N3O2/c1-2-18(16-6-4-3-5-7-16)14-21(15-18)17(22)19-8-9-20-10-12-23-13-11-20/h3-7H,2,8-15H2,1H3,(H,19,22)
InChIKeyMRNAHOZFAFQELD-UHFFFAOYSA-N
MW317.43 g/mol
LogP1.69
Rot. Bonds5

About 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide

3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide (PubChem CID 138045017) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide
PubChem CID138045017
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide
SMILESCCC1(c2ccccc2)CN(C(=O)NCCN2CCOCC2)C1
InChIInChI=1S/C18H27N3O2/c1-2-18(16-6-4-3-5-7-16)14-21(15-18)17(22)19-8-9-20-10-12-23-13-11-20/h3-7H,2,8-15H2,1H3,(H,19,22)
InChIKeyMRNAHOZFAFQELD-UHFFFAOYSA-N
XLogP1.69
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-morpholin-4-ylethyl)-3-(1-phenylcyclobutyl)urea
CID 113216911
1-N-(2-morpholin-4-ylethyl)-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108973636
N-(3-morpholin-4-ylpropyl)-4-phenylpiperazine-1-carboxamide
CID 14763453
N-(2-morpholin-4-ylethyl)-2-oxo-2-phenylacetamide
CID 94274550
N'-(2-morpholin-4-ylethyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]oxamide
CID 29344676
N-(2-morpholin-4-ylethyl)-4-(4-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide
CID 113106083
4-morpholin-4-yl-4-phenyl-N-propylpiperidine-1-carboxamide
CID 110637882
N'-benzyl-N'-ethyl-N-(2-morpholin-4-ylethyl)oxamide
CID 108517517
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
1-[[1-(4-methylphenyl)cyclopropyl]methyl]-3-(2-morpholin-4-ylethyl)urea
CID 113213970
3-methyl-N-(2-morpholin-4-ylethyl)-4-oxoimidazolidine-1-carboxamide
CID 75453186

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide?
The IUPAC name of 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide (CID 138045017) is 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide.
What is the SMILES notation for 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide?
The canonical SMILES for 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide is CCC1(c2ccccc2)CN(C(=O)NCCN2CCOCC2)C1.
What is the InChIKey of 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide?
The InChIKey is MRNAHOZFAFQELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-2-18(16-6-4-3-5-7-16)14-21(15-18)17(22)19-8-9-20-10-12-23-13-11-20/h3-7H,2,8-15H2,1H3,(H,19,22).
What are the key properties of 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide?
3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide has a molecular weight of 317.43 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-morpholin-4-ylethyl)-3-phenylazetidine-1-carboxamide is sourced from PubChem (CID 138045017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).