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

C10H18N4O2 — CID 106397822

IUPAC6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
SMILESNCCCCCC(=O)NCCc1ncon1
InChIInChI=1S/C10H18N4O2/c11-6-3-1-2-4-10(15)12-7-5-9-13-8-16-14-9/h8H,1-7,11H2,(H,12,15)
InChIKeyOFDXMYYVDNUMOL-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.25
Rot. Bonds8

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

6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide (PubChem CID 106397822) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
PubChem CID106397822
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
SMILESNCCCCCC(=O)NCCc1ncon1
InChIInChI=1S/C10H18N4O2/c11-6-3-1-2-4-10(15)12-7-5-9-13-8-16-14-9/h8H,1-7,11H2,(H,12,15)
InChIKeyOFDXMYYVDNUMOL-UHFFFAOYSA-N
XLogP0.25
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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
6-amino-4-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide
CID 106397604
4-hydroxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]pentanamide
CID 106409914
7-amino-N-[2-(1H-imidazol-2-yl)ethyl]heptanamide
CID 113267585
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
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
6-amino-N-[2-(1H-imidazol-5-yl)ethyl]hexanamide
CID 19065170
1-[2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 106394720
1-[2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 106394710

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The IUPAC name of 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide (CID 106397822) is 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide.
What is the SMILES notation for 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The canonical SMILES for 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide is NCCCCCC(=O)NCCc1ncon1.
What is the InChIKey of 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
The InChIKey is OFDXMYYVDNUMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c11-6-3-1-2-4-10(15)12-7-5-9-13-8-16-14-9/h8H,1-7,11H2,(H,12,15).
What are the key properties of 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide?
6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide has a molecular weight of 226.28 g/mol, XLogP of 0.25, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]hexanamide is sourced from PubChem (CID 106397822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).