2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

C15H19N5S — CID 70770351

IUPAC2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC(C)c2csc(C)n2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H19N5S/c1-8-6-14(17-11(4)13-7-21-12(5)18-13)20-15(16-8)9(2)10(3)19-20/h6-7,11,17H,1-5H3
InChIKeyNGLREHHZMOELIA-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.59
Rot. Bonds3

About 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine

2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70770351) has the molecular formula C15H19N5S and a molecular weight of 301.42 g/mol. Its IUPAC name is 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70770351
Molecular FormulaC15H19N5S
Molecular Weight301.42 g/mol
Exact Mass301.14
IUPAC Name2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC(C)c2csc(C)n2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H19N5S/c1-8-6-14(17-11(4)13-7-21-12(5)18-13)20-15(16-8)9(2)10(3)19-20/h6-7,11,17H,1-5H3
InChIKeyNGLREHHZMOELIA-UHFFFAOYSA-N
XLogP3.59
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(ethylthio)ethyl]-2,3,5-trimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56883514
N,2,3,5-tetramethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70768449
2,3,5-trimethyl-N-{2-[(1-methyl-1H-imidazol-2-yl)thio]ethyl}pyrazolo[1,5-a]pyrimidin-7-amine
CID 56900700
2,3,5-trimethyl-N-[1-(2H-tetrazol-5-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70708814
5-ethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70711262
N-[(2-isopropyl-1,3-thiazol-4-yl)methyl]-N,2-dimethyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
CID 56897832
N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56908202
N~7~-[2-(4-ethyl-1,3-thiazol-2-yl)ethyl][1,2,4]triazolo[4,3-c]pyrimidine-5,7-diamine
CID 131944685
3-methyl-N-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 164638440
7-N-[1-(5-fluoro-4-methyl-1,3-thiazol-2-yl)ethyl]-5-N-(piperidin-4-ylmethyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine-5,7-diamine
CID 169597116
5-N-(piperidin-4-ylmethyl)-3-propan-2-yl-7-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-diamine
CID 169597237
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 18155796

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 70770351) is 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(NC(C)c2csc(C)n2)n2nc(C)c(C)c2n1.
What is the InChIKey of 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is NGLREHHZMOELIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5S/c1-8-6-14(17-11(4)13-7-21-12(5)18-13)20-15(16-8)9(2)10(3)19-20/h6-7,11,17H,1-5H3.
What are the key properties of 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine?
2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 301.42 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70770351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).