N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide

C17H22N4O3 — CID 91915171

IUPACN,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CC(Oc2ccc(-c3nc(C)no3)cc2)C1
InChIInChI=1S/C17H22N4O3/c1-4-20(5-2)17(22)21-10-15(11-21)23-14-8-6-13(7-9-14)16-18-12(3)19-24-16/h6-9,15H,4-5,10-11H2,1-3H3
InChIKeyOMMBCSSPNWNCQK-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.57
Rot. Bonds5

About N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide

N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide (PubChem CID 91915171) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide
PubChem CID91915171
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC NameN,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CC(Oc2ccc(-c3nc(C)no3)cc2)C1
InChIInChI=1S/C17H22N4O3/c1-4-20(5-2)17(22)21-10-15(11-21)23-14-8-6-13(7-9-14)16-18-12(3)19-24-16/h6-9,15H,4-5,10-11H2,1-3H3
InChIKeyOMMBCSSPNWNCQK-UHFFFAOYSA-N
XLogP2.57
TPSA71.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-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

3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-N-propan-2-ylazetidine-1-carboxamide
CID 91915170
(2-methoxyphenyl)-[3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidin-1-yl]methanone
CID 91905450
5-[4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]azetidin-3-yl]oxyphenyl]-3-methyl-1,2,4-oxadiazole
CID 91905431
3-methyl-5-[4-[1-(1-methylimidazol-4-yl)sulfonylazetidin-3-yl]oxyphenyl]-1,2,4-oxadiazole
CID 91905427
5-[4-(cyclopropylmethoxy)phenyl]-3-methyl-1,2,4-oxadiazole
CID 91283745
(2,5-difluorophenyl)-[3-[3-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidin-1-yl]methanone
CID 91905523
N,N-diethyl-3-[[6-(trifluoromethyl)-2-pyridinyl]oxy]azetidine-1-carboxamide
CID 122252087
2-(3-methoxyphenyl)-1-[3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidin-1-yl]ethanone
CID 91905478
tert-butyl 4-[cyclopropyl-[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl]amino]piperidine-1-carboxylate
CID 118300916
[3-[4-(5-phenyl-1,2,4-oxadiazol-3-yl)phenoxy]pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 91915163
4-(3-methyl-1,2,4-oxadiazol-5-yl)phenol
CID 3692407
N-[(5-bromo-2-fluorophenyl)methyl]-N-ethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide
CID 55594677

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide?
The IUPAC name of N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide (CID 91915171) is N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide?
The canonical SMILES for N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide is CCN(CC)C(=O)N1CC(Oc2ccc(-c3nc(C)no3)cc2)C1.
What is the InChIKey of N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide?
The InChIKey is OMMBCSSPNWNCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-4-20(5-2)17(22)21-10-15(11-21)23-14-8-6-13(7-9-14)16-18-12(3)19-24-16/h6-9,15H,4-5,10-11H2,1-3H3.
What are the key properties of N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide?
N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carboxamide is sourced from PubChem (CID 91915171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).