5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine

C15H23N5 — CID 80992723

IUPAC5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C(C)C)nc(-n2cc(C)cn2)c1C
InChIInChI=1S/C15H23N5/c1-6-7-16-14-12(5)15(19-13(18-14)10(2)3)20-9-11(4)8-17-20/h8-10H,6-7H2,1-5H3,(H,16,18,19)
InChIKeySNVFWQAZYVEIFY-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.22
Rot. Bonds5

About 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine

5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine (PubChem CID 80992723) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
PubChem CID80992723
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C(C)C)nc(-n2cc(C)cn2)c1C
InChIInChI=1S/C15H23N5/c1-6-7-16-14-12(5)15(19-13(18-14)10(2)3)20-9-11(4)8-17-20/h8-10H,6-7H2,1-5H3,(H,16,18,19)
InChIKeySNVFWQAZYVEIFY-UHFFFAOYSA-N
XLogP3.22
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-4-N-(1-methylpyrazol-4-yl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80991736
4-N-butyl-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80980995
6-(4-iodopyrazol-1-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80988536
2-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]ethanol
CID 80981937
4-N-(3,3-dimethylbutan-2-yl)-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 104830615
2-methyl-3-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]propan-1-ol
CID 80991979
N,5-dimethyl-6-(4-methylpyrazol-1-yl)-2-propylpyrimidin-4-amine
CID 80992979
5-methyl-6-(3-methylmorpholin-4-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80986419
5-methyl-4-N-(3-methylsulfanylpropyl)-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80984789
N-butyl-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81000479
5-methyl-6-(4-methyl-3-pyridinyl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80975870
4-N-hexan-2-yl-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80984973

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The IUPAC name of 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine (CID 80992723) is 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The canonical SMILES for 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine is CCCNc1nc(C(C)C)nc(-n2cc(C)cn2)c1C.
What is the InChIKey of 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
The InChIKey is SNVFWQAZYVEIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-6-7-16-14-12(5)15(19-13(18-14)10(2)3)20-9-11(4)8-17-20/h8-10H,6-7H2,1-5H3,(H,16,18,19).
What are the key properties of 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine?
5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-(4-methylpyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80992723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).