4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide

C7H9FN4O2 — CID 70685822

IUPAC4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide
SMILESNC(=O)c1cnc(OCCF)nc1N
InChIInChI=1S/C7H9FN4O2/c8-1-2-14-7-11-3-4(6(10)13)5(9)12-7/h3H,1-2H2,(H2,10,13)(H2,9,11,12)
InChIKeyYSDSCTDZSPUYMG-UHFFFAOYSA-N
MW200.17 g/mol
LogP-0.49
Rot. Bonds4

About 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide

4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide (PubChem CID 70685822) has the molecular formula C7H9FN4O2 and a molecular weight of 200.17 g/mol. Its IUPAC name is 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide
PubChem CID70685822
Molecular FormulaC7H9FN4O2
Molecular Weight200.17 g/mol
Exact Mass200.07
IUPAC Name4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide
SMILESNC(=O)c1cnc(OCCF)nc1N
InChIInChI=1S/C7H9FN4O2/c8-1-2-14-7-11-3-4(6(10)13)5(9)12-7/h3H,1-2H2,(H2,10,13)(H2,9,11,12)
InChIKeyYSDSCTDZSPUYMG-UHFFFAOYSA-N
XLogP-0.49
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.17
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide?
The IUPAC name of 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide (CID 70685822) is 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide.
What is the SMILES notation for 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide?
The canonical SMILES for 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide is NC(=O)c1cnc(OCCF)nc1N.
What is the InChIKey of 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide?
The InChIKey is YSDSCTDZSPUYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN4O2/c8-1-2-14-7-11-3-4(6(10)13)5(9)12-7/h3H,1-2H2,(H2,10,13)(H2,9,11,12).
What are the key properties of 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide?
4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide has a molecular weight of 200.17 g/mol, XLogP of -0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(2-fluoroethoxy)pyrimidine-5-carboxamide is sourced from PubChem (CID 70685822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).