N-ethyl-5-fluoropyrimidin-2-amine

C6H8FN3 — CID 53385549

IUPACN-ethyl-5-fluoropyrimidin-2-amine
SMILESCCNc1ncc(F)cn1
InChIInChI=1S/C6H8FN3/c1-2-8-6-9-3-5(7)4-10-6/h3-4H,2H2,1H3,(H,8,9,10)
InChIKeySGAGTLALNMXHSE-UHFFFAOYSA-N
MW141.15 g/mol
LogP1.05
Rot. Bonds2

About N-ethyl-5-fluoropyrimidin-2-amine

N-ethyl-5-fluoropyrimidin-2-amine (PubChem CID 53385549) has the molecular formula C6H8FN3 and a molecular weight of 141.15 g/mol. Its IUPAC name is N-ethyl-5-fluoropyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-fluoropyrimidin-2-amine
PubChem CID53385549
Molecular FormulaC6H8FN3
Molecular Weight141.15 g/mol
Exact Mass141.07
IUPAC NameN-ethyl-5-fluoropyrimidin-2-amine
SMILESCCNc1ncc(F)cn1
InChIInChI=1S/C6H8FN3/c1-2-8-6-9-3-5(7)4-10-6/h3-4H,2H2,1H3,(H,8,9,10)
InChIKeySGAGTLALNMXHSE-UHFFFAOYSA-N
XLogP1.05
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.15
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-fluoropyrimidin-2-amine?
The IUPAC name of N-ethyl-5-fluoropyrimidin-2-amine (CID 53385549) is N-ethyl-5-fluoropyrimidin-2-amine.
What is the SMILES notation for N-ethyl-5-fluoropyrimidin-2-amine?
The canonical SMILES for N-ethyl-5-fluoropyrimidin-2-amine is CCNc1ncc(F)cn1.
What is the InChIKey of N-ethyl-5-fluoropyrimidin-2-amine?
The InChIKey is SGAGTLALNMXHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3/c1-2-8-6-9-3-5(7)4-10-6/h3-4H,2H2,1H3,(H,8,9,10).
What are the key properties of N-ethyl-5-fluoropyrimidin-2-amine?
N-ethyl-5-fluoropyrimidin-2-amine has a molecular weight of 141.15 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-fluoropyrimidin-2-amine is sourced from PubChem (CID 53385549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).