N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide

C8H10FN3O — CID 66624238

IUPACN-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ncc(F)cn1
InChIInChI=1S/C8H10FN3O/c1-5(12-6(2)13)8-10-3-7(9)4-11-8/h3-5H,1-2H3,(H,12,13)
InChIKeyPEZGEWRPYXVHEJ-UHFFFAOYSA-N
MW183.19 g/mol
LogP0.81
Rot. Bonds2

About N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide

N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide (PubChem CID 66624238) has the molecular formula C8H10FN3O and a molecular weight of 183.19 g/mol. Its IUPAC name is N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide
PubChem CID66624238
Molecular FormulaC8H10FN3O
Molecular Weight183.19 g/mol
Exact Mass183.08
IUPAC NameN-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ncc(F)cn1
InChIInChI=1S/C8H10FN3O/c1-5(12-6(2)13)8-10-3-7(9)4-11-8/h3-5H,1-2H3,(H,12,13)
InChIKeyPEZGEWRPYXVHEJ-UHFFFAOYSA-N
XLogP0.81
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.19
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide?
The IUPAC name of N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide (CID 66624238) is N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide is CC(=O)NC(C)c1ncc(F)cn1.
What is the InChIKey of N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide?
The InChIKey is PEZGEWRPYXVHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3O/c1-5(12-6(2)13)8-10-3-7(9)4-11-8/h3-5H,1-2H3,(H,12,13).
What are the key properties of N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide?
N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide has a molecular weight of 183.19 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-fluoropyrimidin-2-yl)ethyl]acetamide is sourced from PubChem (CID 66624238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).