4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine

C10H12N4S — CID 104577485

IUPAC4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NCc2cncs2)n1
InChIInChI=1S/C10H12N4S/c1-7-3-8(2)14-10(13-7)12-5-9-4-11-6-15-9/h3-4,6H,5H2,1-2H3,(H,12,13,14)
InChIKeyADVNKVPOELKQIT-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.16
Rot. Bonds3

About 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine

4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine (PubChem CID 104577485) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
PubChem CID104577485
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC Name4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NCc2cncs2)n1
InChIInChI=1S/C10H12N4S/c1-7-3-8(2)14-10(13-7)12-5-9-4-11-6-15-9/h3-4,6H,5H2,1-2H3,(H,12,13,14)
InChIKeyADVNKVPOELKQIT-UHFFFAOYSA-N
XLogP2.16
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4,5-dimethylthiophen-2-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 65245675
5-methyl-N-(1,3-thiazol-5-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 115924966
4-methoxy-N-(1,3-thiazol-5-ylmethyl)aniline
CID 62760158
4,6-dimethyl-N-(1,3-thiazol-2-ylmethyl)pyrimidin-2-amine
CID 61283291
4-methoxy-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine
CID 104577405
1-(3,5-dimethylphenyl)-N-(1,3-thiazol-5-ylmethyl)ethanamine
CID 115732390
2-methyl-N-(1,3-thiazol-5-ylmethyl)-3H-benzimidazol-5-amine
CID 62759070
4-N,4-N,2-trimethyl-1-N-(1,3-thiazol-5-ylmethyl)benzene-1,4-diamine
CID 62759246
N-(1,3-thiazol-5-ylmethyl)hydroxylamine
CID 82687431
3-methyl-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine
CID 115735497
N-methylsulfanyl-1-(1,3-thiazol-5-yl)methanamine
CID 143609838
1-(1,3-thiazol-5-yl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine
CID 115732227

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine (CID 104577485) is 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine is Cc1cc(C)nc(NCc2cncs2)n1.
What is the InChIKey of 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
The InChIKey is ADVNKVPOELKQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-7-3-8(2)14-10(13-7)12-5-9-4-11-6-15-9/h3-4,6H,5H2,1-2H3,(H,12,13,14).
What are the key properties of 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine?
4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine has a molecular weight of 220.30 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 104577485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).