2,6-difluoropyrimidin-4-amine

C4H3F2N3 — CID 582916

IUPAC2,6-difluoropyrimidin-4-amine
SMILESNc1cc(F)nc(F)n1
InChIInChI=1S/C4H3F2N3/c5-2-1-3(7)9-4(6)8-2/h1H,(H2,7,8,9)
InChIKeyBBASDBMEDBTAHV-UHFFFAOYSA-N
MW131.09 g/mol
LogP0.34
Rot. Bonds

About 2,6-difluoropyrimidin-4-amine

2,6-difluoropyrimidin-4-amine (PubChem CID 582916) has the molecular formula C4H3F2N3 and a molecular weight of 131.09 g/mol. Its IUPAC name is 2,6-difluoropyrimidin-4-amine.

Molecular Properties

Compound Name2,6-difluoropyrimidin-4-amine
PubChem CID582916
Molecular FormulaC4H3F2N3
Molecular Weight131.09 g/mol
Exact Mass131.03
IUPAC Name2,6-difluoropyrimidin-4-amine
SMILESNc1cc(F)nc(F)n1
InChIInChI=1S/C4H3F2N3/c5-2-1-3(7)9-4(6)8-2/h1H,(H2,7,8,9)
InChIKeyBBASDBMEDBTAHV-UHFFFAOYSA-N
XLogP0.34
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.09
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,6-Triaminopyrimidine
CID 13863
4-Pyrimidinamine, 2,6-dichloro-
CID 82387
Pyrimidine-4,6-diamine
CID 79608
2,6-difluoro-N-methylpyrimidin-4-amine
CID 3941302
6-Chloro-2-(trifluoromethyl)pyrimidin-4-amine
CID 245271
N4,N4-dimethylpyrimidine-2,4,6-triamine
CID 23423800
2,4,6-Trifluoropyrimidine
CID 69677
4,6-Difluoropyrimidine
CID 137717
6-Fluoro-4-pyrimidinamine
CID 574613
2,6-Difluoro-N,N-dimethyl-4-pyrimidinamine
CID 594436
N-ethyl-4,6-difluoropyrimidin-2-amine
CID 676431
N4-butyl-6-fluoropyrimidine-2,4-diamine
CID 2780461

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoropyrimidin-4-amine?
The IUPAC name of 2,6-difluoropyrimidin-4-amine (CID 582916) is 2,6-difluoropyrimidin-4-amine.
What is the SMILES notation for 2,6-difluoropyrimidin-4-amine?
The canonical SMILES for 2,6-difluoropyrimidin-4-amine is Nc1cc(F)nc(F)n1.
What is the InChIKey of 2,6-difluoropyrimidin-4-amine?
The InChIKey is BBASDBMEDBTAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F2N3/c5-2-1-3(7)9-4(6)8-2/h1H,(H2,7,8,9).
What are the key properties of 2,6-difluoropyrimidin-4-amine?
2,6-difluoropyrimidin-4-amine has a molecular weight of 131.09 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoropyrimidin-4-amine is sourced from PubChem (CID 582916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).