5-[(6-fluoro-2-pyridinyl)amino]pentanamide

C10H14FN3O — CID 106239975

IUPAC5-[(6-fluoro-2-pyridinyl)amino]pentanamide
SMILESNC(=O)CCCCNc1cccc(F)n1
InChIInChI=1S/C10H14FN3O/c11-8-4-3-6-10(14-8)13-7-2-1-5-9(12)15/h3-4,6H,1-2,5,7H2,(H2,12,15)(H,13,14)
InChIKeyRTCZQILXSOYSKB-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.29
Rot. Bonds6

About 5-[(6-fluoro-2-pyridinyl)amino]pentanamide

5-[(6-fluoro-2-pyridinyl)amino]pentanamide (PubChem CID 106239975) has the molecular formula C10H14FN3O and a molecular weight of 211.24 g/mol. Its IUPAC name is 5-[(6-fluoro-2-pyridinyl)amino]pentanamide.

Molecular Properties

Compound Name5-[(6-fluoro-2-pyridinyl)amino]pentanamide
PubChem CID106239975
Molecular FormulaC10H14FN3O
Molecular Weight211.24 g/mol
Exact Mass211.11
IUPAC Name5-[(6-fluoro-2-pyridinyl)amino]pentanamide
SMILESNC(=O)CCCCNc1cccc(F)n1
InChIInChI=1S/C10H14FN3O/c11-8-4-3-6-10(14-8)13-7-2-1-5-9(12)15/h3-4,6H,1-2,5,7H2,(H2,12,15)(H,13,14)
InChIKeyRTCZQILXSOYSKB-UHFFFAOYSA-N
XLogP1.29
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-fluoro-2-pyridinyl)amino]pentanamide?
The IUPAC name of 5-[(6-fluoro-2-pyridinyl)amino]pentanamide (CID 106239975) is 5-[(6-fluoro-2-pyridinyl)amino]pentanamide.
What is the SMILES notation for 5-[(6-fluoro-2-pyridinyl)amino]pentanamide?
The canonical SMILES for 5-[(6-fluoro-2-pyridinyl)amino]pentanamide is NC(=O)CCCCNc1cccc(F)n1.
What is the InChIKey of 5-[(6-fluoro-2-pyridinyl)amino]pentanamide?
The InChIKey is RTCZQILXSOYSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O/c11-8-4-3-6-10(14-8)13-7-2-1-5-9(12)15/h3-4,6H,1-2,5,7H2,(H2,12,15)(H,13,14).
What are the key properties of 5-[(6-fluoro-2-pyridinyl)amino]pentanamide?
5-[(6-fluoro-2-pyridinyl)amino]pentanamide has a molecular weight of 211.24 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-fluoro-2-pyridinyl)amino]pentanamide is sourced from PubChem (CID 106239975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).