N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide

C20H19N3O2 — CID 20973288

IUPACN-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
SMILESO=C(NC1CCCC1)c1cccc(-c2nc(-c3ccccc3)no2)c1
InChIInChI=1S/C20H19N3O2/c24-19(21-17-11-4-5-12-17)15-9-6-10-16(13-15)20-22-18(23-25-20)14-7-2-1-3-8-14/h1-3,6-10,13,17H,4-5,11-12H2,(H,21,24)
InChIKeyKGQKYOJXXAFRMM-UHFFFAOYSA-N
MW333.39 g/mol
LogP4.08
Rot. Bonds4

About N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide

N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide (PubChem CID 20973288) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
PubChem CID20973288
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
SMILESO=C(NC1CCCC1)c1cccc(-c2nc(-c3ccccc3)no2)c1
InChIInChI=1S/C20H19N3O2/c24-19(21-17-11-4-5-12-17)15-9-6-10-16(13-15)20-22-18(23-25-20)14-7-2-1-3-8-14/h1-3,6-10,13,17H,4-5,11-12H2,(H,21,24)
InChIKeyKGQKYOJXXAFRMM-UHFFFAOYSA-N
XLogP4.08
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]benzamide
CID 46385501
N-(2-phenylethyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 20973301
3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-pyridin-2-ylbenzamide
CID 50828682
3-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)benzoic acid
CID 65390325
N-[(2S)-butan-2-yl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 92729267
N-cycloheptyl-3-(3-methylphenyl)-1,2,4-oxadiazole-5-carboxamide
CID 6471248
N-(1,3-benzodioxol-5-yl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 50828830
N-(2-methoxyphenyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 50828728
N-[(4-methoxyphenyl)methyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 20973291
N-cyclopentyl-3-phenoxybenzamide
CID 2684460
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid
CID 44621438
N-cyclohexyl-2-[2-methoxy-4-(5-phenyl-1,2,4-oxadiazol-3-yl)phenoxy]acetamide
CID 46267182

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide?
The IUPAC name of N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide (CID 20973288) is N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide.
What is the SMILES notation for N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide?
The canonical SMILES for N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide is O=C(NC1CCCC1)c1cccc(-c2nc(-c3ccccc3)no2)c1.
What is the InChIKey of N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide?
The InChIKey is KGQKYOJXXAFRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c24-19(21-17-11-4-5-12-17)15-9-6-10-16(13-15)20-22-18(23-25-20)14-7-2-1-3-8-14/h1-3,6-10,13,17H,4-5,11-12H2,(H,21,24).
What are the key properties of N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide?
N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide has a molecular weight of 333.39 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide is sourced from PubChem (CID 20973288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).