2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide

C15H19FN4O2 — CID 71986954

IUPAC2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
SMILESCCCc1noc(CN(C)C(C(N)=O)c2cccc(F)c2)n1
InChIInChI=1S/C15H19FN4O2/c1-3-5-12-18-13(22-19-12)9-20(2)14(15(17)21)10-6-4-7-11(16)8-10/h4,6-8,14H,3,5,9H2,1-2H3,(H2,17,21)
InChIKeyZNHVLMVOQPGDEP-UHFFFAOYSA-N
MW306.34 g/mol
LogP1.82
Rot. Bonds7

About 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide

2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide (PubChem CID 71986954) has the molecular formula C15H19FN4O2 and a molecular weight of 306.34 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
PubChem CID71986954
Molecular FormulaC15H19FN4O2
Molecular Weight306.34 g/mol
Exact Mass306.15
IUPAC Name2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
SMILESCCCc1noc(CN(C)C(C(N)=O)c2cccc(F)c2)n1
InChIInChI=1S/C15H19FN4O2/c1-3-5-12-18-13(22-19-12)9-20(2)14(15(17)21)10-6-4-7-11(16)8-10/h4,6-8,14H,3,5,9H2,1-2H3,(H2,17,21)
InChIKeyZNHVLMVOQPGDEP-UHFFFAOYSA-N
XLogP1.82
TPSA85.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-fluorophenyl)-2-[[4-(hydroxymethyl)phenyl]methyl-methylamino]acetamide
CID 110009403
(2R)-2-(3-fluorophenyl)-2-[methyl-[(2-phenyl-1,3-oxazol-4-yl)methyl]amino]acetamide
CID 95900005
2-(3-fluorophenyl)-2-[methyl-[(4-phenylphenyl)methyl]amino]acetamide
CID 86886828
methyl 3-[[[(1S)-2-amino-1-(3-fluorophenyl)-2-oxoethyl]-methylamino]methyl]thiophene-2-carboxylate
CID 97054655
(2S)-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl-methylamino]-2-(3-fluorophenyl)acetamide
CID 97158492
1-(3-fluorophenyl)-N-methyl-N-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]methanamine
CID 86920071
2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl-methylamino]-2-(3-fluorophenyl)acetamide
CID 71986955
2-[[2-(2-chlorophenyl)-2-hydroxyethyl]-methylamino]-2-(3-fluorophenyl)acetamide
CID 110930711
2-[5-[[(1R)-1-(3-fluorophenyl)ethyl]sulfanylmethyl]-1,2,4-oxadiazol-3-yl]-N-methylacetamide
CID 97221732
2-(4-methoxyphenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]ethanol
CID 111123352
1-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]propan-2-ol
CID 62332798
(2R)-2-(3-fluorophenyl)-2-[methyl-[2-[[(2S)-oxolan-2-yl]methoxy]ethyl]amino]acetamide
CID 99105593

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide (CID 71986954) is 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide is CCCc1noc(CN(C)C(C(N)=O)c2cccc(F)c2)n1.
What is the InChIKey of 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide?
The InChIKey is ZNHVLMVOQPGDEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O2/c1-3-5-12-18-13(22-19-12)9-20(2)14(15(17)21)10-6-4-7-11(16)8-10/h4,6-8,14H,3,5,9H2,1-2H3,(H2,17,21).
What are the key properties of 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide?
2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide has a molecular weight of 306.34 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide is sourced from PubChem (CID 71986954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).