2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide

C15H19FN4O — CID 119266330

IUPAC2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(C)nn1-c1ccc(F)cc1
InChIInChI=1S/C15H19FN4O/c1-3-4-13(17)15(21)18-14-9-10(2)19-20(14)12-7-5-11(16)6-8-12/h5-9,13H,3-4,17H2,1-2H3,(H,18,21)
InChIKeyGBFBLMHFVCHORM-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.39
Rot. Bonds5

About 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide

2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide (PubChem CID 119266330) has the molecular formula C15H19FN4O and a molecular weight of 290.34 g/mol. Its IUPAC name is 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide
PubChem CID119266330
Molecular FormulaC15H19FN4O
Molecular Weight290.34 g/mol
Exact Mass290.15
IUPAC Name2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(C)nn1-c1ccc(F)cc1
InChIInChI=1S/C15H19FN4O/c1-3-4-13(17)15(21)18-14-9-10(2)19-20(14)12-7-5-11(16)6-8-12/h5-9,13H,3-4,17H2,1-2H3,(H,18,21)
InChIKeyGBFBLMHFVCHORM-UHFFFAOYSA-N
XLogP2.39
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide?
The IUPAC name of 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide (CID 119266330) is 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide.
What is the SMILES notation for 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide?
The canonical SMILES for 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide is CCCC(N)C(=O)Nc1cc(C)nn1-c1ccc(F)cc1.
What is the InChIKey of 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide?
The InChIKey is GBFBLMHFVCHORM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O/c1-3-4-13(17)15(21)18-14-9-10(2)19-20(14)12-7-5-11(16)6-8-12/h5-9,13H,3-4,17H2,1-2H3,(H,18,21).
What are the key properties of 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide?
2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide has a molecular weight of 290.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]pentanamide is sourced from PubChem (CID 119266330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).