6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine

C15H20N4OS — CID 144538323

IUPAC6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NCc2cnc(C)s2)cc(OCCC2CC2)n1
InChIInChI=1S/C15H20N4OS/c1-10-18-14(17-9-13-8-16-11(2)21-13)7-15(19-10)20-6-5-12-3-4-12/h7-8,12H,3-6,9H2,1-2H3,(H,17,18,19)
InChIKeyLREYQYIZKFCSGY-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.34
Rot. Bonds7

About 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine

6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine (PubChem CID 144538323) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine
PubChem CID144538323
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC Name6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NCc2cnc(C)s2)cc(OCCC2CC2)n1
InChIInChI=1S/C15H20N4OS/c1-10-18-14(17-9-13-8-16-11(2)21-13)7-15(19-10)20-6-5-12-3-4-12/h7-8,12H,3-6,9H2,1-2H3,(H,17,18,19)
InChIKeyLREYQYIZKFCSGY-UHFFFAOYSA-N
XLogP3.34
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-cyclopropylethoxy)-2-methyl-N-propylpyrimidin-4-amine
CID 114158202
[6-(2-cyclobutylethoxy)-2-methylpyrimidin-4-yl]hydrazine
CID 106207928
3-cyclopropyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-1-amine
CID 115639558
2-tert-butyl-6-N-ethyl-4-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidine-4,6-diamine
CID 80960726
4-ethoxy-6-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-2-amine
CID 112637077
6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
CID 144538357
6-N-ethyl-4-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771282
2-tert-butyl-6-(methoxymethyl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine
CID 133404924
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methyl-6-[2-(2-pyridin-2-ylcyclopropyl)ethoxy]pyrimidin-4-amine
CID 123178301
2-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80866216
N-(cyclobutylmethyl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326683
2-ethyl-4-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80934863

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine (CID 144538323) is 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine is Cc1nc(NCc2cnc(C)s2)cc(OCCC2CC2)n1.
What is the InChIKey of 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine?
The InChIKey is LREYQYIZKFCSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-10-18-14(17-9-13-8-16-11(2)21-13)7-15(19-10)20-6-5-12-3-4-12/h7-8,12H,3-6,9H2,1-2H3,(H,17,18,19).
What are the key properties of 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine?
6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine has a molecular weight of 304.42 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylethoxy)-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 144538323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).