2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine

C14H20N4S — CID 134710131

IUPAC2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NC(C)c1nc(C)cs1
InChIInChI=1S/C14H20N4S/c1-5-6-12-7-15-11(4)18-13(12)17-10(3)14-16-9(2)8-19-14/h7-8,10H,5-6H2,1-4H3,(H,15,17,18)
InChIKeyVLPHLKAYVGFPNH-UHFFFAOYSA-N
MW276.41 g/mol
LogP3.68
Rot. Bonds5

About 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine

2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine (PubChem CID 134710131) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
PubChem CID134710131
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NC(C)c1nc(C)cs1
InChIInChI=1S/C14H20N4S/c1-5-6-12-7-15-11(4)18-13(12)17-10(3)14-16-9(2)8-19-14/h7-8,10H,5-6H2,1-4H3,(H,15,17,18)
InChIKeyVLPHLKAYVGFPNH-UHFFFAOYSA-N
XLogP3.68
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-2-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
CID 79534289
2-N-ethyl-4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328270
6-N,2-diethyl-4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80942180
2-hydrazinyl-5-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917854
4-chloro-2-methyl-6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrimidine-5-carbaldehyde
CID 80725960
6-N-methyl-4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propan-2-ylpyrimidine-4,6-diamine
CID 80845227
5-chloro-4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 106811993
N-[(2-methyl-1H-imidazol-5-yl)methyl]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 63091931
N-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]-7H-purin-6-amine
CID 39782171
6-chloro-2-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80843860
6-ethoxy-4-N-methyl-2-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 80843765
4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328271

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The IUPAC name of 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine (CID 134710131) is 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine is CCCc1cnc(C)nc1NC(C)c1nc(C)cs1.
What is the InChIKey of 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
The InChIKey is VLPHLKAYVGFPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-5-6-12-7-15-11(4)18-13(12)17-10(3)14-16-9(2)8-19-14/h7-8,10H,5-6H2,1-4H3,(H,15,17,18).
What are the key properties of 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine?
2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine has a molecular weight of 276.41 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-5-propylpyrimidin-4-amine is sourced from PubChem (CID 134710131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).