N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide

C10H16N4O3 — CID 56868229

IUPACN-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCCc1nnc(C(=O)N(C)CC(=O)NC)o1
InChIInChI=1S/C10H16N4O3/c1-4-5-8-12-13-9(17-8)10(16)14(3)6-7(15)11-2/h4-6H2,1-3H3,(H,11,15)
InChIKeyZSZYKTNGSPEJQI-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.16
Rot. Bonds5

About N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide

N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide (PubChem CID 56868229) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide
PubChem CID56868229
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCCc1nnc(C(=O)N(C)CC(=O)NC)o1
InChIInChI=1S/C10H16N4O3/c1-4-5-8-12-13-9(17-8)10(16)14(3)6-7(15)11-2/h4-6H2,1-3H3,(H,11,15)
InChIKeyZSZYKTNGSPEJQI-UHFFFAOYSA-N
XLogP-0.16
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide (CID 56868229) is N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide is CCCc1nnc(C(=O)N(C)CC(=O)NC)o1.
What is the InChIKey of N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is ZSZYKTNGSPEJQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-4-5-8-12-13-9(17-8)10(16)14(3)6-7(15)11-2/h4-6H2,1-3H3,(H,11,15).
What are the key properties of N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide?
N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of -0.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-propyl-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 56868229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).