2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide

C14H16N4O3 — CID 119323625

IUPAC2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide
SMILESNCC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1
InChIInChI=1S/C14H16N4O3/c15-7-13(19)16-10-3-5-11(6-4-10)20-8-12-17-14(21-18-12)9-1-2-9/h3-6,9H,1-2,7-8,15H2,(H,16,19)
InChIKeyIBARFDFDPBAJEX-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.42
Rot. Bonds6

About 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide

2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide (PubChem CID 119323625) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide
PubChem CID119323625
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide
SMILESNCC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1
InChIInChI=1S/C14H16N4O3/c15-7-13(19)16-10-3-5-11(6-4-10)20-8-12-17-14(21-18-12)9-1-2-9/h3-6,9H,1-2,7-8,15H2,(H,16,19)
InChIKeyIBARFDFDPBAJEX-UHFFFAOYSA-N
XLogP1.42
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide?
The IUPAC name of 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide (CID 119323625) is 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide?
The canonical SMILES for 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide is NCC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1.
What is the InChIKey of 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide?
The InChIKey is IBARFDFDPBAJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c15-7-13(19)16-10-3-5-11(6-4-10)20-8-12-17-14(21-18-12)9-1-2-9/h3-6,9H,1-2,7-8,15H2,(H,16,19).
What are the key properties of 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide?
2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide has a molecular weight of 288.31 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 119323625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).