4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide

C11H19N5O2 — CID 72883330

IUPAC4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCCc1nnc(N2CCN(C(=O)N(C)C)CC2)o1
InChIInChI=1S/C11H19N5O2/c1-4-9-12-13-10(18-9)15-5-7-16(8-6-15)11(17)14(2)3/h4-8H2,1-3H3
InChIKeyOVKYXJNWYWOUQM-UHFFFAOYSA-N
MW253.31 g/mol
LogP0.44
Rot. Bonds2

About 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide

4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide (PubChem CID 72883330) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide
PubChem CID72883330
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC Name4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCCc1nnc(N2CCN(C(=O)N(C)C)CC2)o1
InChIInChI=1S/C11H19N5O2/c1-4-9-12-13-10(18-9)15-5-7-16(8-6-15)11(17)14(2)3/h4-8H2,1-3H3
InChIKeyOVKYXJNWYWOUQM-UHFFFAOYSA-N
XLogP0.44
TPSA65.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-(2-morpholin-4-ylethyl)-5-propyl-1,3,4-oxadiazol-2-amine
CID 72864936
1-(5-Ethyl-1,3,4-oxadiazol-2-YL)-4-(3-methoxypropyl)piperazine
CID 72879776
1-(5-Ethyl-1,3,4-oxadiazol-2-yl)-4-(methylsulfonyl)piperazine
CID 72927859
4-(5-Methyl-1,3,4-oxadiazol-2-yl)-1-(2-methylpropyl)piperazin-2-one
CID 121538121
2,2-Dimethyl-1-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperazin-1-yl]propan-1-one
CID 126750279
1-[4-[5-(Trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperazin-1-yl]ethanone
CID 126758393
1-(5-Propyl-1,3,4-oxadiazol-2-YL)-4-(2,2,2-trifluoroethyl)piperazine
CID 72909400
2-Ethyl-5-piperazin-1-yl-1,3,4-oxadiazole
CID 28808823
1-[4-(5-Methyl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]ethanone
CID 110419007
N,N-dimethyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)piperazine-1-carboxamide
CID 110419079
1-[4-(5-Ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]propan-1-one
CID 110603079
4-(5-Methyl-[1,3,4]oxadiazol-2-yl)-piperazine-1-carboxylic acid tert-butyl ester
CID 117954169

Frequently Asked Questions

What is the IUPAC name of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide?
The IUPAC name of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide (CID 72883330) is 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide?
The canonical SMILES for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide is CCc1nnc(N2CCN(C(=O)N(C)C)CC2)o1.
What is the InChIKey of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide?
The InChIKey is OVKYXJNWYWOUQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-4-9-12-13-10(18-9)15-5-7-16(8-6-15)11(17)14(2)3/h4-8H2,1-3H3.
What are the key properties of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide?
4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide has a molecular weight of 253.31 g/mol, XLogP of 0.44, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylpiperazine-1-carboxamide is sourced from PubChem (CID 72883330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).