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

C9H10N4S — CID 60706641

IUPACN-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
SMILESCc1csc(CNc2ncccn2)n1
InChIInChI=1S/C9H10N4S/c1-7-6-14-8(13-7)5-12-9-10-3-2-4-11-9/h2-4,6H,5H2,1H3,(H,10,11,12)
InChIKeyWDHKBGZBGLGASM-UHFFFAOYSA-N
MW206.27 g/mol
LogP1.85
Rot. Bonds3

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

N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine (PubChem CID 60706641) has the molecular formula C9H10N4S and a molecular weight of 206.27 g/mol. Its IUPAC name is N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
PubChem CID60706641
Molecular FormulaC9H10N4S
Molecular Weight206.27 g/mol
Exact Mass206.06
IUPAC NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
SMILESCc1csc(CNc2ncccn2)n1
InChIInChI=1S/C9H10N4S/c1-7-6-14-8(13-7)5-12-9-10-3-2-4-11-9/h2-4,6H,5H2,1H3,(H,10,11,12)
InChIKeyWDHKBGZBGLGASM-UHFFFAOYSA-N
XLogP1.85
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
CID 60733825
1-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,2,4-triazol-3-amine
CID 130686343
5,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,2,4-triazin-3-amine
CID 114448176
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-3-amine
CID 82539208
2-(4-methyl-1,3-thiazol-2-yl)-N-pyrimidin-2-ylacetamide
CID 110484384
4-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-N-propylpyrimidine-2,4-diamine
CID 80807385
2,3,4,5,6-pentafluoro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]aniline
CID 60706687
5,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrazin-2-amine
CID 114475451
2-fluoro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 80695663
1-(2-methylpyrimidin-4-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine
CID 62747714
5-chloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-2-amine
CID 130670306
2,2-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]butan-1-amine
CID 103698488

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine?
The IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine (CID 60706641) is N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine.
What is the SMILES notation for N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine?
The canonical SMILES for N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine is Cc1csc(CNc2ncccn2)n1.
What is the InChIKey of N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine?
The InChIKey is WDHKBGZBGLGASM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4S/c1-7-6-14-8(13-7)5-12-9-10-3-2-4-11-9/h2-4,6H,5H2,1H3,(H,10,11,12).
What are the key properties of N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine?
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine has a molecular weight of 206.27 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 60706641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).