2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine

C14H15F2N3 — CID 63562473

IUPAC2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(-c2cc(F)cc(F)c2)nc(NC)c1C
InChIInChI=1S/C14H15F2N3/c1-4-12-8(2)13(17-3)19-14(18-12)9-5-10(15)7-11(16)6-9/h5-7H,4H2,1-3H3,(H,17,18,19)
InChIKeyZVWZUIULGOAAOX-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.33
Rot. Bonds3

About 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine

2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine (PubChem CID 63562473) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
PubChem CID63562473
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(-c2cc(F)cc(F)c2)nc(NC)c1C
InChIInChI=1S/C14H15F2N3/c1-4-12-8(2)13(17-3)19-14(18-12)9-5-10(15)7-11(16)6-9/h5-7H,4H2,1-3H3,(H,17,18,19)
InChIKeyZVWZUIULGOAAOX-UHFFFAOYSA-N
XLogP3.33
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-ethyl-2-(4-ethylphenyl)-N,5-dimethylpyrimidin-4-amine
CID 63562088
2-(3-bromo-5-fluorophenyl)-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 66423893
6-ethyl-N,5-dimethyl-2-pyrimidin-2-ylpyrimidin-4-amine
CID 63561722
2-(3-chloro-4-methoxyphenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 65022448
2-(3-bromo-5-fluorophenyl)-6-ethyl-5-methylpyrimidin-4-amine
CID 66426085
2-(2,4-dimethylphenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63561539
[6-ethyl-2-(3-fluoro-4-methylphenyl)-5-methylpyrimidin-4-yl]hydrazine
CID 63562540
2-(4,5-dibromothiophen-2-yl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 102843905
2-(2,6-dichlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 55222206
2-(2-chlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63560185
5-ethyl-N,6-dimethyl-2-(3,4,5-trifluorophenyl)pyrimidin-4-amine
CID 62191599
6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
CID 103375001

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine (CID 63562473) is 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine is CCc1nc(-c2cc(F)cc(F)c2)nc(NC)c1C.
What is the InChIKey of 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine?
The InChIKey is ZVWZUIULGOAAOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-4-12-8(2)13(17-3)19-14(18-12)9-5-10(15)7-11(16)6-9/h5-7H,4H2,1-3H3,(H,17,18,19).
What are the key properties of 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine?
2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine has a molecular weight of 263.29 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 63562473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).