2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide

C11H20N4O3 — CID 114186098

IUPAC2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
SMILESCOCCCC(N)C(=O)NCCc1nc(C)no1
InChIInChI=1S/C11H20N4O3/c1-8-14-10(18-15-8)5-6-13-11(16)9(12)4-3-7-17-2/h9H,3-7,12H2,1-2H3,(H,13,16)
InChIKeyQZWWFOFQSPNXNW-UHFFFAOYSA-N
MW256.31 g/mol
LogP-0.21
Rot. Bonds8

About 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide

2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide (PubChem CID 114186098) has the molecular formula C11H20N4O3 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
PubChem CID114186098
Molecular FormulaC11H20N4O3
Molecular Weight256.31 g/mol
Exact Mass256.15
IUPAC Name2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide
SMILESCOCCCC(N)C(=O)NCCc1nc(C)no1
InChIInChI=1S/C11H20N4O3/c1-8-14-10(18-15-8)5-6-13-11(16)9(12)4-3-7-17-2/h9H,3-7,12H2,1-2H3,(H,13,16)
InChIKeyQZWWFOFQSPNXNW-UHFFFAOYSA-N
XLogP-0.21
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 5-0.21
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

2-amino-3-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 103796130
3-amino-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 103810155
2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
CID 81081158
(2S)-2-amino-3-(4-hydroxyphenyl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]propanamide
CID 106416404
2-amino-5-methoxy-N-(4-methylpentyl)pentanamide
CID 81089350
2-(aminomethyl)-3-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 107269486
2-amino-5-methoxy-N-propylpentanamide
CID 81082005
2-amino-5-methoxy-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pentanamide
CID 81088105
N'-(cyanomethyl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]oxamide
CID 106417469
2-bromo-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 106415376
2-iodo-3,3-dimethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 89148487
4-amino-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 103796132

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide?
The IUPAC name of 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide (CID 114186098) is 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide.
What is the SMILES notation for 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide?
The canonical SMILES for 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide is COCCCC(N)C(=O)NCCc1nc(C)no1.
What is the InChIKey of 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide?
The InChIKey is QZWWFOFQSPNXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3/c1-8-14-10(18-15-8)5-6-13-11(16)9(12)4-3-7-17-2/h9H,3-7,12H2,1-2H3,(H,13,16).
What are the key properties of 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide?
2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide has a molecular weight of 256.31 g/mol, XLogP of -0.21, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide is sourced from PubChem (CID 114186098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).