4-(5-fluoropyrimidin-2-yl)butanamide

C8H10FN3O — CID 67017175

IUPAC4-(5-fluoropyrimidin-2-yl)butanamide
SMILESNC(=O)CCCc1ncc(F)cn1
InChIInChI=1S/C8H10FN3O/c9-6-4-11-8(12-5-6)3-1-2-7(10)13/h4-5H,1-3H2,(H2,10,13)
InChIKeyVMOAPQOYWUFEMK-UHFFFAOYSA-N
MW183.19 g/mol
LogP0.42
Rot. Bonds4

About 4-(5-fluoropyrimidin-2-yl)butanamide

4-(5-fluoropyrimidin-2-yl)butanamide (PubChem CID 67017175) has the molecular formula C8H10FN3O and a molecular weight of 183.19 g/mol. Its IUPAC name is 4-(5-fluoropyrimidin-2-yl)butanamide.

Molecular Properties

Compound Name4-(5-fluoropyrimidin-2-yl)butanamide
PubChem CID67017175
Molecular FormulaC8H10FN3O
Molecular Weight183.19 g/mol
Exact Mass183.08
IUPAC Name4-(5-fluoropyrimidin-2-yl)butanamide
SMILESNC(=O)CCCc1ncc(F)cn1
InChIInChI=1S/C8H10FN3O/c9-6-4-11-8(12-5-6)3-1-2-7(10)13/h4-5H,1-3H2,(H2,10,13)
InChIKeyVMOAPQOYWUFEMK-UHFFFAOYSA-N
XLogP0.42
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.19
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(5-fluoropyrimidin-2-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoropyrimidin-2-yl)butanamide?
The IUPAC name of 4-(5-fluoropyrimidin-2-yl)butanamide (CID 67017175) is 4-(5-fluoropyrimidin-2-yl)butanamide.
What is the SMILES notation for 4-(5-fluoropyrimidin-2-yl)butanamide?
The canonical SMILES for 4-(5-fluoropyrimidin-2-yl)butanamide is NC(=O)CCCc1ncc(F)cn1.
What is the InChIKey of 4-(5-fluoropyrimidin-2-yl)butanamide?
The InChIKey is VMOAPQOYWUFEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3O/c9-6-4-11-8(12-5-6)3-1-2-7(10)13/h4-5H,1-3H2,(H2,10,13).
What are the key properties of 4-(5-fluoropyrimidin-2-yl)butanamide?
4-(5-fluoropyrimidin-2-yl)butanamide has a molecular weight of 183.19 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoropyrimidin-2-yl)butanamide is sourced from PubChem (CID 67017175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).