6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine

C14H20N4OS — CID 62795873

IUPAC6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(COC)nc(Cc2nc(C)cs2)n1
InChIInChI=1S/C14H20N4OS/c1-4-5-15-12-6-11(8-19-3)17-13(18-12)7-14-16-10(2)9-20-14/h6,9H,4-5,7-8H2,1-3H3,(H,15,17,18)
InChIKeyDMLYYAFLLFGNGU-UHFFFAOYSA-N
MW292.41 g/mol
LogP2.80
Rot. Bonds7

About 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine

6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine (PubChem CID 62795873) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine
PubChem CID62795873
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(COC)nc(Cc2nc(C)cs2)n1
InChIInChI=1S/C14H20N4OS/c1-4-5-15-12-6-11(8-19-3)17-13(18-12)7-14-16-10(2)9-20-14/h6,9H,4-5,7-8H2,1-3H3,(H,15,17,18)
InChIKeyDMLYYAFLLFGNGU-UHFFFAOYSA-N
XLogP2.80
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine?
The IUPAC name of 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine (CID 62795873) is 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine is CCCNc1cc(COC)nc(Cc2nc(C)cs2)n1.
What is the InChIKey of 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine?
The InChIKey is DMLYYAFLLFGNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-4-5-15-12-6-11(8-19-3)17-13(18-12)7-14-16-10(2)9-20-14/h6,9H,4-5,7-8H2,1-3H3,(H,15,17,18).
What are the key properties of 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine?
6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine has a molecular weight of 292.41 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine is sourced from PubChem (CID 62795873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).