N-(3-amino-5-fluoro-2-pyridinyl)formamide

C6H6FN3O — CID 142602489

IUPACN-(3-amino-5-fluoro-2-pyridinyl)formamide
SMILESNc1cc(F)cnc1NC=O
InChIInChI=1S/C6H6FN3O/c7-4-1-5(8)6(9-2-4)10-3-11/h1-3H,8H2,(H,9,10,11)
InChIKeyROUMWZGLDNEKNP-UHFFFAOYSA-N
MW155.13 g/mol
LogP0.37
Rot. Bonds2

About N-(3-amino-5-fluoro-2-pyridinyl)formamide

N-(3-amino-5-fluoro-2-pyridinyl)formamide (PubChem CID 142602489) has the molecular formula C6H6FN3O and a molecular weight of 155.13 g/mol. Its IUPAC name is N-(3-amino-5-fluoro-2-pyridinyl)formamide.

Molecular Properties

Compound NameN-(3-amino-5-fluoro-2-pyridinyl)formamide
PubChem CID142602489
Molecular FormulaC6H6FN3O
Molecular Weight155.13 g/mol
Exact Mass155.05
IUPAC NameN-(3-amino-5-fluoro-2-pyridinyl)formamide
SMILESNc1cc(F)cnc1NC=O
InChIInChI=1S/C6H6FN3O/c7-4-1-5(8)6(9-2-4)10-3-11/h1-3H,8H2,(H,9,10,11)
InChIKeyROUMWZGLDNEKNP-UHFFFAOYSA-N
XLogP0.37
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.13
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-5-fluoro-2-pyridinyl)formamide?
The IUPAC name of N-(3-amino-5-fluoro-2-pyridinyl)formamide (CID 142602489) is N-(3-amino-5-fluoro-2-pyridinyl)formamide.
What is the SMILES notation for N-(3-amino-5-fluoro-2-pyridinyl)formamide?
The canonical SMILES for N-(3-amino-5-fluoro-2-pyridinyl)formamide is Nc1cc(F)cnc1NC=O.
What is the InChIKey of N-(3-amino-5-fluoro-2-pyridinyl)formamide?
The InChIKey is ROUMWZGLDNEKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6FN3O/c7-4-1-5(8)6(9-2-4)10-3-11/h1-3H,8H2,(H,9,10,11).
What are the key properties of N-(3-amino-5-fluoro-2-pyridinyl)formamide?
N-(3-amino-5-fluoro-2-pyridinyl)formamide has a molecular weight of 155.13 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-5-fluoro-2-pyridinyl)formamide is sourced from PubChem (CID 142602489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).