2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine

C16H21FN4 — CID 79713717

IUPAC2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2ccc(F)cn2)nc(C)c1C(C)C
InChIInChI=1S/C16H21FN4/c1-5-8-18-16-14(10(2)3)11(4)20-15(21-16)13-7-6-12(17)9-19-13/h6-7,9-10H,5,8H2,1-4H3,(H,18,20,21)
InChIKeyJUZWEKRJTQRHND-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.93
Rot. Bonds5

About 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine

2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine (PubChem CID 79713717) has the molecular formula C16H21FN4 and a molecular weight of 288.37 g/mol. Its IUPAC name is 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
PubChem CID79713717
Molecular FormulaC16H21FN4
Molecular Weight288.37 g/mol
Exact Mass288.18
IUPAC Name2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2ccc(F)cn2)nc(C)c1C(C)C
InChIInChI=1S/C16H21FN4/c1-5-8-18-16-14(10(2)3)11(4)20-15(21-16)13-7-6-12(17)9-19-13/h6-7,9-10H,5,8H2,1-4H3,(H,18,20,21)
InChIKeyJUZWEKRJTQRHND-UHFFFAOYSA-N
XLogP3.93
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-2-(5-fluoro-2-pyridinyl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 79713731
6-methyl-5-propan-2-yl-N-propyl-2-pyrimidin-2-ylpyrimidin-4-amine
CID 62913276
2-(5-fluoro-2-pyridinyl)-6-methyl-N-propylpyrimidin-4-amine
CID 79718258
N-ethyl-2-(4-fluoro-2-methylphenyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 81272931
5-bromo-6-methyl-2-(5-methyl-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 81311702
2-(5-fluoro-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 79717957
2-(2-bromo-4-fluorophenyl)-N-ethyl-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 107281416
2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine
CID 79718495
2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 62915666
2-(4-bromothiophen-2-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 63480516
2-(4-chlorothiophen-2-yl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 79427994
6-methyl-2-(3-methylbutyl)-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 63486822

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine (CID 79713717) is 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine is CCCNc1nc(-c2ccc(F)cn2)nc(C)c1C(C)C.
What is the InChIKey of 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
The InChIKey is JUZWEKRJTQRHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN4/c1-5-8-18-16-14(10(2)3)11(4)20-15(21-16)13-7-6-12(17)9-19-13/h6-7,9-10H,5,8H2,1-4H3,(H,18,20,21).
What are the key properties of 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine?
2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine has a molecular weight of 288.37 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 79713717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).