N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide

C10H18N4O3 — CID 106398768

IUPACN-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide
SMILESCOCCCNC(=O)C(C)NCc1ncon1
InChIInChI=1S/C10H18N4O3/c1-8(10(15)11-4-3-5-16-2)12-6-9-13-7-17-14-9/h7-8,12H,3-6H2,1-2H3,(H,11,15)
InChIKeyDAKCOWDQLYGWNC-UHFFFAOYSA-N
MW242.28 g/mol
LogP-0.30
Rot. Bonds8

About N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide

N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide (PubChem CID 106398768) has the molecular formula C10H18N4O3 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide
PubChem CID106398768
Molecular FormulaC10H18N4O3
Molecular Weight242.28 g/mol
Exact Mass242.14
IUPAC NameN-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide
SMILESCOCCCNC(=O)C(C)NCc1ncon1
InChIInChI=1S/C10H18N4O3/c1-8(10(15)11-4-3-5-16-2)12-6-9-13-7-17-14-9/h7-8,12H,3-6H2,1-2H3,(H,11,15)
InChIKeyDAKCOWDQLYGWNC-UHFFFAOYSA-N
XLogP-0.30
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide
CID 106399027
N-(3-methoxypropyl)-2-[(1-methylpyrazol-3-yl)methylamino]propanamide
CID 82882044
3-(1,2,4-oxadiazol-3-ylmethylamino)butanoic acid
CID 106399040
2-(3-methoxypropylamino)-N-pentylpropanamide
CID 43131874
N-(1,2,4-oxadiazol-3-ylmethyl)-2-propan-2-yloxyethanamine
CID 106398904
methyl 3-[[1-(3-methoxypropylamino)-1-oxopropan-2-yl]amino]propanoate
CID 60719502
N-carbamoyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]propanamide
CID 106401246
N-(3-methoxypropyl)-2-(5-methylsulfanylpentylamino)propanamide
CID 114127252
2-[(2,5-dimethylpyrrol-1-yl)amino]-N-(3-methoxypropyl)propanamide
CID 79099906
2-[(2-bromo-5-fluorophenyl)methylamino]-N-(3-methoxypropyl)propanamide
CID 61017027
1-cyclopropyl-N-(1,2,4-oxadiazol-3-ylmethyl)ethanamine
CID 106393050
2-chloro-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 106395575

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide?
The IUPAC name of N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide (CID 106398768) is N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide is COCCCNC(=O)C(C)NCc1ncon1.
What is the InChIKey of N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide?
The InChIKey is DAKCOWDQLYGWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3/c1-8(10(15)11-4-3-5-16-2)12-6-9-13-7-17-14-9/h7-8,12H,3-6H2,1-2H3,(H,11,15).
What are the key properties of N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide?
N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide has a molecular weight of 242.28 g/mol, XLogP of -0.30, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(1,2,4-oxadiazol-3-ylmethylamino)propanamide is sourced from PubChem (CID 106398768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).