3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide

C18H21N5O4 — CID 146125380

IUPAC3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide
SMILESCc1noc(C2CCCN(C(=O)NCCn3c(=O)oc4ccccc43)C2)n1
InChIInChI=1S/C18H21N5O4/c1-12-20-16(27-21-12)13-5-4-9-22(11-13)17(24)19-8-10-23-14-6-2-3-7-15(14)26-18(23)25/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,19,24)
InChIKeyHNZASGLTBSSXEK-UHFFFAOYSA-N
MW371.40 g/mol
LogP1.88
Rot. Bonds4

About 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide

3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide (PubChem CID 146125380) has the molecular formula C18H21N5O4 and a molecular weight of 371.40 g/mol. Its IUPAC name is 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide
PubChem CID146125380
Molecular FormulaC18H21N5O4
Molecular Weight371.40 g/mol
Exact Mass371.16
IUPAC Name3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide
SMILESCc1noc(C2CCCN(C(=O)NCCn3c(=O)oc4ccccc43)C2)n1
InChIInChI=1S/C18H21N5O4/c1-12-20-16(27-21-12)13-5-4-9-22(11-13)17(24)19-8-10-23-14-6-2-3-7-15(14)26-18(23)25/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,19,24)
InChIKeyHNZASGLTBSSXEK-UHFFFAOYSA-N
XLogP1.88
TPSA106.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-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

N-[[dimethyl(phenyl)silyl]methyl]-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 119038571
(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(3-phenylprop-2-ynyl)piperidine-1-carboxamide
CID 94800955
1-[2-(2-oxo-1,3-benzoxazol-3-yl)ethylcarbamoyl]piperidine-4-carboxylic acid
CID 122001108
N-(cyclohex-3-en-1-ylmethyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 49128178
(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2,4,6-trimethylphenyl)ethyl]piperidine-1-carboxamide
CID 94801111
(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 94178848
(3S)-N-[(4-cyanophenyl)methyl]-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 94801015
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3,3-diphenylpropan-1-one
CID 51120866
(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxamide
CID 52530117
3-[2-[(3R)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]-2-oxoethyl]-1,3-benzoxazol-2-one
CID 124954995
(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[[1-[(R)-methylsulfinyl]cyclobutyl]methyl]piperidine-1-carboxamide
CID 124887439
(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[[1-[(R)-methylsulfinyl]cyclobutyl]methyl]piperidine-1-carboxamide
CID 124887441

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide?
The IUPAC name of 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide (CID 146125380) is 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide is Cc1noc(C2CCCN(C(=O)NCCn3c(=O)oc4ccccc43)C2)n1.
What is the InChIKey of 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide?
The InChIKey is HNZASGLTBSSXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O4/c1-12-20-16(27-21-12)13-5-4-9-22(11-13)17(24)19-8-10-23-14-6-2-3-7-15(14)26-18(23)25/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,19,24).
What are the key properties of 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide?
3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide has a molecular weight of 371.40 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 146125380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).