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

C11H14N4S — CID 61284999

IUPAC4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCc2csc(C)n2)n1
InChIInChI=1S/C11H14N4S/c1-7-4-8(2)14-11(13-7)12-5-10-6-16-9(3)15-10/h4,6H,5H2,1-3H3,(H,12,13,14)
InChIKeySZJNEPANRJDZNH-UHFFFAOYSA-N
MW234.33 g/mol
LogP2.47
Rot. Bonds3

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

4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine (PubChem CID 61284999) has the molecular formula C11H14N4S and a molecular weight of 234.33 g/mol. Its IUPAC name is 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine
PubChem CID61284999
Molecular FormulaC11H14N4S
Molecular Weight234.33 g/mol
Exact Mass234.09
IUPAC Name4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCc2csc(C)n2)n1
InChIInChI=1S/C11H14N4S/c1-7-4-8(2)14-11(13-7)12-5-10-6-16-9(3)15-10/h4,6H,5H2,1-3H3,(H,12,13,14)
InChIKeySZJNEPANRJDZNH-UHFFFAOYSA-N
XLogP2.47
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.33
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-{[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3-thiazol-2-amine
CID 683952
N-[(2-Isopropyl-1,3-thiazol-4-YL)methyl]-4-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 56864914
N~4~-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-5-ethyl-6-methylpyrimidine-2,4-diamine
CID 72896949
4-N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-6-ethylpyrimidine-2,4-diamine
CID 134414944
2-[6-[4-[(2-Methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]ethanamine
CID 45174622
2-N,4-N,4-N,6-tetramethyl-2-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidine-2,4-diamine
CID 53539526
N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
CID 53576345
N~4~-{[2-(dimethylamino)-1,3-thiazol-4-yl]methyl}-6-isopropylpyrimidine-2,4-diamine
CID 72842929
N-{[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]methyl}-2-propyl-1,3-thiazole-4-carboxamide
CID 72861628
6-propan-2-yl-4-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pyrimidine-2,4-diamine
CID 72882505
N-[2-(4,5-Dimethyl-1,3-thiazol-2-YL)ethyl]-1-(6-ethyl-2-methylpyrimidin-4-YL)piperidin-4-amine
CID 72929445
2-(2-((4,6-dimethylpyrimidin-2-yl)amino)thiazol-4-yl)-N-ethylacetamide
CID 49670866

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine (CID 61284999) is 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine is Cc1cc(C)nc(NCc2csc(C)n2)n1.
What is the InChIKey of 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine?
The InChIKey is SZJNEPANRJDZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4S/c1-7-4-8(2)14-11(13-7)12-5-10-6-16-9(3)15-10/h4,6H,5H2,1-3H3,(H,12,13,14).
What are the key properties of 4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine?
4,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine has a molecular weight of 234.33 g/mol, XLogP of 2.47, 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-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 61284999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).