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

C10H17N5O3 — CID 55103954

IUPAC4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide
SMILESCCN(CC)C(=O)CN(C)C(=O)c1nonc1N
InChIInChI=1S/C10H17N5O3/c1-4-15(5-2)7(16)6-14(3)10(17)8-9(11)13-18-12-8/h4-6H2,1-3H3,(H2,11,13)
InChIKeyAMOHJDXIOZVZEI-UHFFFAOYSA-N
MW255.28 g/mol
LogP-0.41
Rot. Bonds5

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

4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide (PubChem CID 55103954) has the molecular formula C10H17N5O3 and a molecular weight of 255.28 g/mol. Its IUPAC name is 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide
PubChem CID55103954
Molecular FormulaC10H17N5O3
Molecular Weight255.28 g/mol
Exact Mass255.13
IUPAC Name4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide
SMILESCCN(CC)C(=O)CN(C)C(=O)c1nonc1N
InChIInChI=1S/C10H17N5O3/c1-4-15(5-2)7(16)6-14(3)10(17)8-9(11)13-18-12-8/h4-6H2,1-3H3,(H2,11,13)
InChIKeyAMOHJDXIOZVZEI-UHFFFAOYSA-N
XLogP-0.41
TPSA105.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide?
The IUPAC name of 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide (CID 55103954) is 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide is CCN(CC)C(=O)CN(C)C(=O)c1nonc1N.
What is the InChIKey of 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide?
The InChIKey is AMOHJDXIOZVZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O3/c1-4-15(5-2)7(16)6-14(3)10(17)8-9(11)13-18-12-8/h4-6H2,1-3H3,(H2,11,13).
What are the key properties of 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide?
4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide has a molecular weight of 255.28 g/mol, XLogP of -0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methyl-1,2,5-oxadiazole-3-carboxamide is sourced from PubChem (CID 55103954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).