4,6-difluoro-N,N-dimethylpyrimidin-2-amine

C6H7F2N3 — CID 594438

IUPAC4,6-difluoro-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1nc(F)cc(F)n1
InChIInChI=1S/C6H7F2N3/c1-11(2)6-9-4(7)3-5(8)10-6/h3H,1-2H3
InChIKeyFETWNAISKMGRGN-UHFFFAOYSA-N
MW159.14 g/mol
LogP0.82
Rot. Bonds1

About 4,6-difluoro-N,N-dimethylpyrimidin-2-amine

4,6-difluoro-N,N-dimethylpyrimidin-2-amine (PubChem CID 594438) has the molecular formula C6H7F2N3 and a molecular weight of 159.14 g/mol. Its IUPAC name is 4,6-difluoro-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4,6-difluoro-N,N-dimethylpyrimidin-2-amine
PubChem CID594438
Molecular FormulaC6H7F2N3
Molecular Weight159.14 g/mol
Exact Mass159.06
IUPAC Name4,6-difluoro-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1nc(F)cc(F)n1
InChIInChI=1S/C6H7F2N3/c1-11(2)6-9-4(7)3-5(8)10-6/h3H,1-2H3
InChIKeyFETWNAISKMGRGN-UHFFFAOYSA-N
XLogP0.82
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

azane;2-N,2-N,4-N,4-N,6-N,6-N-hexamethyl-1,3,5-triazine-2,4,6-triamine
CID 159451135
6-(difluoromethyl)-2-N,2-N,4-N,4-N-tetramethylpyrimidine-2,4-diamine
CID 11790602
6-bromo-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 116796338
4-chloro-6-(3-chloro-4-fluorophenoxy)-N,N-dimethyl-1,3,5-triazin-2-amine
CID 63877958
2-(dimethylamino)-6-(4-fluorophenyl)pyrimidine-4-carbonitrile
CID 39346399
4-chloro-6-[4-fluoro-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1,3,5-triazin-2-amine
CID 107290404
6-chloro-4-N-(2,6-dichloro-4-fluorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 83077703
4-(4-bromo-3-fluorophenoxy)-6-chloro-N,N-dimethyl-1,3,5-triazin-2-amine
CID 65203549
2-N,2-N,4-N,4-N,6-N,6-N-hexamethyl-1,3,5-triazine-2,4,6-triamine;phosphoric acid
CID 172706081
zinc 6-(dimethylamino)-1,3,5-triazine-2,4-dithiolate
CID 110193115
4-N-(3,4-difluorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80763289
4-N-(3-fluoro-5-methylphenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80851450

Frequently Asked Questions

What is the IUPAC name of 4,6-difluoro-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 4,6-difluoro-N,N-dimethylpyrimidin-2-amine (CID 594438) is 4,6-difluoro-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 4,6-difluoro-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 4,6-difluoro-N,N-dimethylpyrimidin-2-amine is CN(C)c1nc(F)cc(F)n1.
What is the InChIKey of 4,6-difluoro-N,N-dimethylpyrimidin-2-amine?
The InChIKey is FETWNAISKMGRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F2N3/c1-11(2)6-9-4(7)3-5(8)10-6/h3H,1-2H3.
What are the key properties of 4,6-difluoro-N,N-dimethylpyrimidin-2-amine?
4,6-difluoro-N,N-dimethylpyrimidin-2-amine has a molecular weight of 159.14 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-difluoro-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 594438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).