N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide

C15H18ClN3O2 — CID 17101557

IUPACN-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide
SMILESCCCCC(=O)NC(C)c1nc(-c2ccccc2Cl)no1
InChIInChI=1S/C15H18ClN3O2/c1-3-4-9-13(20)17-10(2)15-18-14(19-21-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,20)
InChIKeyFCCHCQMTYPQLII-UHFFFAOYSA-N
MW307.78 g/mol
LogP3.76
Rot. Bonds6

About N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide

N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide (PubChem CID 17101557) has the molecular formula C15H18ClN3O2 and a molecular weight of 307.78 g/mol. Its IUPAC name is N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide.

Molecular Properties

Compound NameN-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide
PubChem CID17101557
Molecular FormulaC15H18ClN3O2
Molecular Weight307.78 g/mol
Exact Mass307.11
IUPAC NameN-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide
SMILESCCCCC(=O)NC(C)c1nc(-c2ccccc2Cl)no1
InChIInChI=1S/C15H18ClN3O2/c1-3-4-9-13(20)17-10(2)15-18-14(19-21-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,20)
InChIKeyFCCHCQMTYPQLII-UHFFFAOYSA-N
XLogP3.76
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.78
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide 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-[1-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide
CID 17101380
N-[1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide
CID 17101346
1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-ethylethanamine
CID 63352599
N-[(1R)-1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-5-propan-2-ylthiophene-3-carboxamide
CID 92580919
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-pentan-2-ylpropanamide
CID 133209724
N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-3-methylbenzamide
CID 17101552
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
CID 60606531
N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-3-methoxybenzamide
CID 17101554
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 100758002
N-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]butanamide
CID 6492197
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-ethylbutan-2-amine
CID 63352336
N-[1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]-4-(2-oxopyrrolidin-1-yl)butanamide
CID 131890638

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide?
The IUPAC name of N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide (CID 17101557) is N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide.
What is the SMILES notation for N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide?
The canonical SMILES for N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide is CCCCC(=O)NC(C)c1nc(-c2ccccc2Cl)no1.
What is the InChIKey of N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide?
The InChIKey is FCCHCQMTYPQLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O2/c1-3-4-9-13(20)17-10(2)15-18-14(19-21-15)11-7-5-6-8-12(11)16/h5-8,10H,3-4,9H2,1-2H3,(H,17,20).
What are the key properties of N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide?
N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide has a molecular weight of 307.78 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pentanamide is sourced from PubChem (CID 17101557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).