2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide

C7H7ClFN3O — CID 79727822

IUPAC2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide
SMILESNC(=O)CNc1ncc(Cl)cc1F
InChIInChI=1S/C7H7ClFN3O/c8-4-1-5(9)7(11-2-4)12-3-6(10)13/h1-2H,3H2,(H2,10,13)(H,11,12)
InChIKeyBRKBVSLQKHDZGS-UHFFFAOYSA-N
MW203.60 g/mol
LogP0.77
Rot. Bonds3

About 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide

2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide (PubChem CID 79727822) has the molecular formula C7H7ClFN3O and a molecular weight of 203.60 g/mol. Its IUPAC name is 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide.

Molecular Properties

Compound Name2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide
PubChem CID79727822
Molecular FormulaC7H7ClFN3O
Molecular Weight203.60 g/mol
Exact Mass203.03
IUPAC Name2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide
SMILESNC(=O)CNc1ncc(Cl)cc1F
InChIInChI=1S/C7H7ClFN3O/c8-4-1-5(9)7(11-2-4)12-3-6(10)13/h1-2H,3H2,(H2,10,13)(H,11,12)
InChIKeyBRKBVSLQKHDZGS-UHFFFAOYSA-N
XLogP0.77
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.60
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide?
The IUPAC name of 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide (CID 79727822) is 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide.
What is the SMILES notation for 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide?
The canonical SMILES for 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide is NC(=O)CNc1ncc(Cl)cc1F.
What is the InChIKey of 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide?
The InChIKey is BRKBVSLQKHDZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClFN3O/c8-4-1-5(9)7(11-2-4)12-3-6(10)13/h1-2H,3H2,(H2,10,13)(H,11,12).
What are the key properties of 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide?
2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide has a molecular weight of 203.60 g/mol, XLogP of 0.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-3-fluoro-2-pyridinyl)amino]acetamide is sourced from PubChem (CID 79727822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).