6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide

C11H20N4O2 — CID 106397604

IUPAC6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
SMILESCC(CCN)CCC(=O)NCCc1ncon1
InChIInChI=1S/C11H20N4O2/c1-9(4-6-12)2-3-11(16)13-7-5-10-14-8-17-15-10/h8-9H,2-7,12H2,1H3,(H,13,16)
InChIKeyMDLPCQCXKCTOGV-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.49
Rot. Bonds8

About 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide

6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide (PubChem CID 106397604) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide.

Molecular Properties

Compound Name6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
PubChem CID106397604
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
SMILESCC(CCN)CCC(=O)NCCc1ncon1
InChIInChI=1S/C11H20N4O2/c1-9(4-6-12)2-3-11(16)13-7-5-10-14-8-17-15-10/h8-9H,2-7,12H2,1H3,(H,13,16)
InChIKeyMDLPCQCXKCTOGV-UHFFFAOYSA-N
XLogP0.49
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]pentanamide
CID 106409914
6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
CID 106397822
5-hydroxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]pentanamide
CID 106409912
5-chloro-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]pentanamide
CID 106395564
2-chloro-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 106395575
2-(aminomethyl)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]butanamide
CID 106397697
1-(aminomethyl)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclopropane-1-carboxamide
CID 106397615
3-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-2-phenylpropanamide
CID 106397844
1-[2-(1,2,4-oxadiazol-3-yl)ethyl]-3-propylurea
CID 106395850
2-hydroxy-2-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 106509755
(2S)-3-methyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoylamino]butanoic acid
CID 106404555
2-(cyclopropylamino)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide
CID 106397634

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The IUPAC name of 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide (CID 106397604) is 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide.
What is the SMILES notation for 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The canonical SMILES for 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide is CC(CCN)CCC(=O)NCCc1ncon1.
What is the InChIKey of 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The InChIKey is MDLPCQCXKCTOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-9(4-6-12)2-3-11(16)13-7-5-10-14-8-17-15-10/h8-9H,2-7,12H2,1H3,(H,13,16).
What are the key properties of 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide has a molecular weight of 240.31 g/mol, XLogP of 0.49, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide is sourced from PubChem (CID 106397604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).