N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide

C6H7N3O2 — CID 90885780

IUPACN-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1ncon1
InChIInChI=1S/C6H7N3O2/c10-6(8-4-1-2-4)5-7-3-11-9-5/h3-4H,1-2H2,(H,8,10)
InChIKeyDHHUBZRYQUBCFY-UHFFFAOYSA-N
MW153.14 g/mol
LogP-0.04
Rot. Bonds2

About N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide

N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide (PubChem CID 90885780) has the molecular formula C6H7N3O2 and a molecular weight of 153.14 g/mol. Its IUPAC name is N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
PubChem CID90885780
Molecular FormulaC6H7N3O2
Molecular Weight153.14 g/mol
Exact Mass153.05
IUPAC NameN-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1ncon1
InChIInChI=1S/C6H7N3O2/c10-6(8-4-1-2-4)5-7-3-11-9-5/h3-4H,1-2H2,(H,8,10)
InChIKeyDHHUBZRYQUBCFY-UHFFFAOYSA-N
XLogP-0.04
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide (CID 90885780) is N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide is O=C(NC1CC1)c1ncon1.
What is the InChIKey of N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is DHHUBZRYQUBCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O2/c10-6(8-4-1-2-4)5-7-3-11-9-5/h3-4H,1-2H2,(H,8,10).
What are the key properties of N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide?
N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 153.14 g/mol, XLogP of -0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 90885780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).