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

C18H24N4O2 — CID 119317591

IUPACN-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide
SMILESCCc1noc(-c2ccc(CCNC(=O)C3CCCNC3)cc2)n1
InChIInChI=1S/C18H24N4O2/c1-2-16-21-18(24-22-16)14-7-5-13(6-8-14)9-11-20-17(23)15-4-3-10-19-12-15/h5-8,15,19H,2-4,9-12H2,1H3,(H,20,23)
InChIKeyBOPPZKMEWMGQLI-UHFFFAOYSA-N
MW328.42 g/mol
LogP1.96
Rot. Bonds6

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

N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide (PubChem CID 119317591) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide
PubChem CID119317591
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide
SMILESCCc1noc(-c2ccc(CCNC(=O)C3CCCNC3)cc2)n1
InChIInChI=1S/C18H24N4O2/c1-2-16-21-18(24-22-16)14-7-5-13(6-8-14)9-11-20-17(23)15-4-3-10-19-12-15/h5-8,15,19H,2-4,9-12H2,1H3,(H,20,23)
InChIKeyBOPPZKMEWMGQLI-UHFFFAOYSA-N
XLogP1.96
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-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-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
CID 119317579
9-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120988914
N-[2-(4-hydroxyphenyl)ethyl]piperidine-3-carboxamide
CID 61238567
(3R,4S)-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 120930962
N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide
CID 110482448
2-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]-2-methylpentanamide
CID 119773286
N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]pyrrolidine-3-sulfonamide;2,2,2-trifluoroacetic acid
CID 167881805
(2S)-2-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]propanamide;hydrochloride
CID 119317564
2-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]-2-(oxan-4-yl)acetamide
CID 120792048
3-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]propanamide;hydrochloride
CID 119317568
1-(cyclopropylmethyl)-3-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]-2-methylguanidine
CID 111868178
(3R)-N-[2-(4-nitrophenyl)ethyl]piperidine-3-carboxamide
CID 81140879

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide?
The IUPAC name of N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide (CID 119317591) is N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide is CCc1noc(-c2ccc(CCNC(=O)C3CCCNC3)cc2)n1.
What is the InChIKey of N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide?
The InChIKey is BOPPZKMEWMGQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-2-16-21-18(24-22-16)14-7-5-13(6-8-14)9-11-20-17(23)15-4-3-10-19-12-15/h5-8,15,19H,2-4,9-12H2,1H3,(H,20,23).
What are the key properties of N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide?
N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 119317591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).