4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine

C12H17N5O — CID 81346031

IUPAC4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine
SMILESCCCNc1nccc(Oc2cc(C)nn2C)n1
InChIInChI=1S/C12H17N5O/c1-4-6-13-12-14-7-5-10(15-12)18-11-8-9(2)16-17(11)3/h5,7-8H,4,6H2,1-3H3,(H,13,14,15)
InChIKeyFGJPVMFNPIEAMK-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.13
Rot. Bonds5

About 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine

4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine (PubChem CID 81346031) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine
PubChem CID81346031
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine
SMILESCCCNc1nccc(Oc2cc(C)nn2C)n1
InChIInChI=1S/C12H17N5O/c1-4-6-13-12-14-7-5-10(15-12)18-11-8-9(2)16-17(11)3/h5,7-8H,4,6H2,1-3H3,(H,13,14,15)
InChIKeyFGJPVMFNPIEAMK-UHFFFAOYSA-N
XLogP2.13
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-N-propylpyrimidin-2-amine
CID 81346874
N-propyl-4-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine
CID 80877277
4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-amine
CID 81346798
4-(4-methylphenoxy)-N-propylpyrimidin-2-amine
CID 80862544
4-(2-bromo-4-methylphenoxy)-N-propylpyrimidin-2-amine
CID 80860263
4-(3,4-difluorophenoxy)-N-propylpyrimidin-2-amine
CID 80875190
N-propyl-4-(1-propylpyrazol-4-yl)oxypyrimidin-2-amine
CID 116806272
6-(2,5-dimethylpyrazol-3-yl)oxy-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 81346792
4-(3-iodophenoxy)-N-propylpyrimidin-2-amine
CID 80881871
4-propan-2-yloxy-N-propylpyrimidin-2-amine
CID 80860726
2-[2-(propylamino)pyrimidin-4-yl]oxyethanol
CID 80860272
4-(2-methyl-5-nitrophenoxy)-N-propylpyrimidin-2-amine
CID 80878871

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine?
The IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine (CID 81346031) is 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine is CCCNc1nccc(Oc2cc(C)nn2C)n1.
What is the InChIKey of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine?
The InChIKey is FGJPVMFNPIEAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-4-6-13-12-14-7-5-10(15-12)18-11-8-9(2)16-17(11)3/h5,7-8H,4,6H2,1-3H3,(H,13,14,15).
What are the key properties of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine?
4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine has a molecular weight of 247.30 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-propylpyrimidin-2-amine is sourced from PubChem (CID 81346031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).