2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine

C14H19N3S — CID 62202584

IUPAC2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(C)nc(-c2cc(C)sc2C)n1
InChIInChI=1S/C14H19N3S/c1-5-6-15-13-7-9(2)16-14(17-13)12-8-10(3)18-11(12)4/h7-8H,5-6H2,1-4H3,(H,15,16,17)
InChIKeyGFWYKNDFYPJXBT-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.95
Rot. Bonds4

About 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine

2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine (PubChem CID 62202584) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine
PubChem CID62202584
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC Name2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(C)nc(-c2cc(C)sc2C)n1
InChIInChI=1S/C14H19N3S/c1-5-6-15-13-7-9(2)16-14(17-13)12-8-10(3)18-11(12)4/h7-8H,5-6H2,1-4H3,(H,15,16,17)
InChIKeyGFWYKNDFYPJXBT-UHFFFAOYSA-N
XLogP3.95
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopropyl-2-(2,5-dimethylthiophen-3-yl)-N-propylpyrimidin-4-amine
CID 63354644
6-methyl-2-(2-methylphenyl)-N-propylpyrimidin-4-amine
CID 62192485
2-(2,5-dimethylthiophen-3-yl)-5-fluoro-6-methyl-N-propylpyrimidin-4-amine
CID 66000619
2-(4-bromo-2-methylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 103083738
2-(4-tert-butylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 63485987
5-bromo-2-(2,5-dimethylthiophen-3-yl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 66297751
2-(2-methoxy-4-methylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 106793012
6-methyl-N-propyl-2-(3,4,5-trifluorophenyl)pyrimidin-4-amine
CID 62190181
[2-(2,5-dimethylthiophen-3-yl)-6-propylpyrimidin-4-yl]hydrazine
CID 62252217
2-(5-fluoro-2-pyridinyl)-6-methyl-N-propylpyrimidin-4-amine
CID 79718258
2-(2,5-dimethylthiophen-3-yl)-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 55045831
6-methyl-2-(4-propan-2-yloxyphenyl)-N-propylpyrimidin-4-amine
CID 63485807

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine (CID 62202584) is 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine is CCCNc1cc(C)nc(-c2cc(C)sc2C)n1.
What is the InChIKey of 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine?
The InChIKey is GFWYKNDFYPJXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-5-6-15-13-7-9(2)16-14(17-13)12-8-10(3)18-11(12)4/h7-8H,5-6H2,1-4H3,(H,15,16,17).
What are the key properties of 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine?
2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine has a molecular weight of 261.39 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylthiophen-3-yl)-6-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 62202584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).