6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine

C8H11F2N3O — CID 58756322

IUPAC6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine
SMILESCc1nc(OC(F)F)cc(N(C)C)n1
InChIInChI=1S/C8H11F2N3O/c1-5-11-6(13(2)3)4-7(12-5)14-8(9)10/h4,8H,1-3H3
InChIKeyYJBNGSDEWIAZPP-UHFFFAOYSA-N
MW203.19 g/mol
LogP1.45
Rot. Bonds3

About 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine

6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine (PubChem CID 58756322) has the molecular formula C8H11F2N3O and a molecular weight of 203.19 g/mol. Its IUPAC name is 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine
PubChem CID58756322
Molecular FormulaC8H11F2N3O
Molecular Weight203.19 g/mol
Exact Mass203.09
IUPAC Name6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine
SMILESCc1nc(OC(F)F)cc(N(C)C)n1
InChIInChI=1S/C8H11F2N3O/c1-5-11-6(13(2)3)4-7(12-5)14-8(9)10/h4,8H,1-3H3
InChIKeyYJBNGSDEWIAZPP-UHFFFAOYSA-N
XLogP1.45
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-Dimethoxy-4-aminopyrimidine
CID 76789
4-Amino-6-methoxypyrimidine
CID 735731
2,4,6-Trimethoxypyrimidine
CID 726938
4,6-Dimethoxypyrimidine-2-carbonitrile
CID 21466113
2,4-Diamino-6-methoxypyrimidine
CID 816925
4,6-Dimethoxy-2-pyrrolidin-1-ylpyrimidine
CID 90342261
2-Amino-6-fluoro-4-methoxypyrimidine
CID 759140
6-Methoxy-2-methylpyrimidin-4-amine
CID 549435
N'-(4,6-dimethoxypyrimidin-2-yl)-N,N-dimethylmethanimidamide
CID 9583216
4-Methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25129178
4-N-butyl-6-methoxypyrimidine-2,4-diamine
CID 103817396
4-Fluoro-2,6-dimethoxypyrimidine
CID 594067

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine?
The IUPAC name of 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine (CID 58756322) is 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine.
What is the SMILES notation for 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine?
The canonical SMILES for 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine is Cc1nc(OC(F)F)cc(N(C)C)n1.
What is the InChIKey of 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine?
The InChIKey is YJBNGSDEWIAZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3O/c1-5-11-6(13(2)3)4-7(12-5)14-8(9)10/h4,8H,1-3H3.
What are the key properties of 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine?
6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine has a molecular weight of 203.19 g/mol, XLogP of 1.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-N,N,2-trimethylpyrimidin-4-amine is sourced from PubChem (CID 58756322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).