N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide

C18H23N3O2 — CID 3160371

IUPACN-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESO=C(CCCc1nc(-c2ccccc2)no1)NC1CCCCC1
InChIInChI=1S/C18H23N3O2/c22-16(19-15-10-5-2-6-11-15)12-7-13-17-20-18(21-23-17)14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2,(H,19,22)
InChIKeyWANYLWQNBDSNDA-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.51
Rot. Bonds6

About N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide

N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide (PubChem CID 3160371) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide
PubChem CID3160371
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide
SMILESO=C(CCCc1nc(-c2ccccc2)no1)NC1CCCCC1
InChIInChI=1S/C18H23N3O2/c22-16(19-15-10-5-2-6-11-15)12-7-13-17-20-18(21-23-17)14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2,(H,19,22)
InChIKeyWANYLWQNBDSNDA-UHFFFAOYSA-N
XLogP3.51
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide?
The IUPAC name of N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide (CID 3160371) is N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide.
What is the SMILES notation for N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide?
The canonical SMILES for N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide is O=C(CCCc1nc(-c2ccccc2)no1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide?
The InChIKey is WANYLWQNBDSNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c22-16(19-15-10-5-2-6-11-15)12-7-13-17-20-18(21-23-17)14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2,(H,19,22).
What are the key properties of N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide?
N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide has a molecular weight of 313.40 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanamide is sourced from PubChem (CID 3160371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).