N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide

C10H15N3O2 — CID 166864775

IUPACN-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide
SMILESCC(C)c1nc(C(=O)NC2(C)CC2)no1
InChIInChI=1S/C10H15N3O2/c1-6(2)9-11-7(13-15-9)8(14)12-10(3)4-5-10/h6H,4-5H2,1-3H3,(H,12,14)
InChIKeyDNPBRZNBLXAJBV-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.48
Rot. Bonds3

About N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide

N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide (PubChem CID 166864775) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide
PubChem CID166864775
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide
SMILESCC(C)c1nc(C(=O)NC2(C)CC2)no1
InChIInChI=1S/C10H15N3O2/c1-6(2)9-11-7(13-15-9)8(14)12-10(3)4-5-10/h6H,4-5H2,1-3H3,(H,12,14)
InChIKeyDNPBRZNBLXAJBV-UHFFFAOYSA-N
XLogP1.48
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide (CID 166864775) is N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide is CC(C)c1nc(C(=O)NC2(C)CC2)no1.
What is the InChIKey of N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is DNPBRZNBLXAJBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-6(2)9-11-7(13-15-9)8(14)12-10(3)4-5-10/h6H,4-5H2,1-3H3,(H,12,14).
What are the key properties of N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide?
N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopropyl)-5-propan-2-yl-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 166864775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).