1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine

C11H14N4OS — CID 102952808

IUPAC1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
SMILESCNCc1sc(-c2cc(OC)ncn2)nc1C
InChIInChI=1S/C11H14N4OS/c1-7-9(5-12-2)17-11(15-7)8-4-10(16-3)14-6-13-8/h4,6,12H,5H2,1-3H3
InChIKeyMHXQEXOOFKCIFU-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.64
Rot. Bonds4

About 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine

1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine (PubChem CID 102952808) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
PubChem CID102952808
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
SMILESCNCc1sc(-c2cc(OC)ncn2)nc1C
InChIInChI=1S/C11H14N4OS/c1-7-9(5-12-2)17-11(15-7)8-4-10(16-3)14-6-13-8/h4,6,12H,5H2,1-3H3
InChIKeyMHXQEXOOFKCIFU-UHFFFAOYSA-N
XLogP1.64
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-(6-methoxypyrimidin-4-yl)-4-propan-2-yl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 102952841
1-[2-(6-methoxypyridazin-3-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 103375095
1-[2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-4-yl]-N-methylmethanamine
CID 102952552
N-[[4-ethyl-2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 102952823
N-[[4-cyclopropyl-2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 102952854
N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 102952840
4-ethoxy-2-(6-methoxypyrimidin-4-yl)-1,3-thiazole-5-carbonitrile
CID 135379881
methyl 5-acetyl-2-(6-methoxypyrimidin-4-yl)-1,3-thiazole-4-carboxylate
CID 106696568
2-(6-methoxypyrimidin-4-yl)-N,6-dimethylpyrimidin-4-amine
CID 102952684
N-[[4-methyl-2-(4-methyl-2-pyridinyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 63839460
N-methyl-1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]methanamine
CID 116868204
2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-4-ol
CID 130501534

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine (CID 102952808) is 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine is CNCc1sc(-c2cc(OC)ncn2)nc1C.
What is the InChIKey of 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine?
The InChIKey is MHXQEXOOFKCIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-7-9(5-12-2)17-11(15-7)8-4-10(16-3)14-6-13-8/h4,6,12H,5H2,1-3H3.
What are the key properties of 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine?
1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine has a molecular weight of 250.33 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine is sourced from PubChem (CID 102952808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).