6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine

C11H14N4OS — CID 114127983

IUPAC6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
SMILESCOc1ncnc(NCc2ncc(C)s2)c1C
InChIInChI=1S/C11H14N4OS/c1-7-4-12-9(17-7)5-13-10-8(2)11(16-3)15-6-14-10/h4,6H,5H2,1-3H3,(H,13,14,15)
InChIKeyKNDKWATZCFTWFB-UHFFFAOYSA-N
MW250.33 g/mol
LogP2.17
Rot. Bonds4

About 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine

6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 114127983) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID114127983
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
SMILESCOc1ncnc(NCc2ncc(C)s2)c1C
InChIInChI=1S/C11H14N4OS/c1-7-4-12-9(17-7)5-13-10-8(2)11(16-3)15-6-14-10/h4,6H,5H2,1-3H3,(H,13,14,15)
InChIKeyKNDKWATZCFTWFB-UHFFFAOYSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
CID 114128058
6-methoxy-5-methyl-N-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-amine
CID 66325637
6-methoxy-5-methyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 66327251
6-methoxy-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66324994
6-methoxy-5-methyl-N-propylpyrimidin-4-amine
CID 66326211
N-(1H-imidazol-2-ylmethyl)-6-methoxy-5-methylpyrimidin-4-amine
CID 66327904
5-methoxy-4-[(5-methyl-1,3-thiazol-2-yl)methylamino]-1H-pyrimidin-6-one
CID 136999745
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 79241724
6-methoxy-5-methyl-N-(1H-pyrazol-5-ylmethyl)pyrimidin-4-amine
CID 66327266
N-(6-methoxy-5-methylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 66327244
2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide
CID 66327451
N-hexyl-6-methoxy-5-methylpyrimidin-4-amine
CID 66325235

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine (CID 114127983) is 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine is COc1ncnc(NCc2ncc(C)s2)c1C.
What is the InChIKey of 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is KNDKWATZCFTWFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-7-4-12-9(17-7)5-13-10-8(2)11(16-3)15-6-14-10/h4,6H,5H2,1-3H3,(H,13,14,15).
What are the key properties of 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine?
6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 250.33 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 114127983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).