N-carbamoyl-5-fluoropyridine-3-carboxamide

C7H6FN3O2 — CID 104786685

IUPACN-carbamoyl-5-fluoropyridine-3-carboxamide
SMILESNC(=O)NC(=O)c1cncc(F)c1
InChIInChI=1S/C7H6FN3O2/c8-5-1-4(2-10-3-5)6(12)11-7(9)13/h1-3H,(H3,9,11,12,13)
InChIKeyWGAGUEIVZTWJCB-UHFFFAOYSA-N
MW183.14 g/mol
LogP0.03
Rot. Bonds1

About N-carbamoyl-5-fluoropyridine-3-carboxamide

N-carbamoyl-5-fluoropyridine-3-carboxamide (PubChem CID 104786685) has the molecular formula C7H6FN3O2 and a molecular weight of 183.14 g/mol. Its IUPAC name is N-carbamoyl-5-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-carbamoyl-5-fluoropyridine-3-carboxamide
PubChem CID104786685
Molecular FormulaC7H6FN3O2
Molecular Weight183.14 g/mol
Exact Mass183.04
IUPAC NameN-carbamoyl-5-fluoropyridine-3-carboxamide
SMILESNC(=O)NC(=O)c1cncc(F)c1
InChIInChI=1S/C7H6FN3O2/c8-5-1-4(2-10-3-5)6(12)11-7(9)13/h1-3H,(H3,9,11,12,13)
InChIKeyWGAGUEIVZTWJCB-UHFFFAOYSA-N
XLogP0.03
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.14
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-5-fluoropyridine-3-carboxamide?
The IUPAC name of N-carbamoyl-5-fluoropyridine-3-carboxamide (CID 104786685) is N-carbamoyl-5-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-carbamoyl-5-fluoropyridine-3-carboxamide?
The canonical SMILES for N-carbamoyl-5-fluoropyridine-3-carboxamide is NC(=O)NC(=O)c1cncc(F)c1.
What is the InChIKey of N-carbamoyl-5-fluoropyridine-3-carboxamide?
The InChIKey is WGAGUEIVZTWJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6FN3O2/c8-5-1-4(2-10-3-5)6(12)11-7(9)13/h1-3H,(H3,9,11,12,13).
What are the key properties of N-carbamoyl-5-fluoropyridine-3-carboxamide?
N-carbamoyl-5-fluoropyridine-3-carboxamide has a molecular weight of 183.14 g/mol, XLogP of 0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-5-fluoropyridine-3-carboxamide is sourced from PubChem (CID 104786685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).