N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide

C12H17N3O2 — CID 50754876

IUPACN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide
SMILESO=C(NCc1noc(C2CCCC2)n1)C1CC1
InChIInChI=1S/C12H17N3O2/c16-11(8-5-6-8)13-7-10-14-12(17-15-10)9-3-1-2-4-9/h8-9H,1-7H2,(H,13,16)
InChIKeyLCIGVNBMLACGLP-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.75
Rot. Bonds4

About N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide (PubChem CID 50754876) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide
PubChem CID50754876
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide
SMILESO=C(NCc1noc(C2CCCC2)n1)C1CC1
InChIInChI=1S/C12H17N3O2/c16-11(8-5-6-8)13-7-10-14-12(17-15-10)9-3-1-2-4-9/h8-9H,1-7H2,(H,13,16)
InChIKeyLCIGVNBMLACGLP-UHFFFAOYSA-N
XLogP1.75
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide (CID 50754876) is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide is O=C(NCc1noc(C2CCCC2)n1)C1CC1.
What is the InChIKey of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide?
The InChIKey is LCIGVNBMLACGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c16-11(8-5-6-8)13-7-10-14-12(17-15-10)9-3-1-2-4-9/h8-9H,1-7H2,(H,13,16).
What are the key properties of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide?
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide has a molecular weight of 235.29 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 50754876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).