N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine

C14H17N7 — CID 106715906

IUPACN-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCNc1cc(-c2cnn(C)c2)nc(-c2cncn2C)n1
InChIInChI=1S/C14H17N7/c1-4-16-13-5-11(10-6-17-21(3)8-10)18-14(19-13)12-7-15-9-20(12)2/h5-9H,4H2,1-3H3,(H,16,18,19)
InChIKeyQTKNSNOYIQFKTK-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.71
Rot. Bonds4

About N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine

N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine (PubChem CID 106715906) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
PubChem CID106715906
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC NameN-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCNc1cc(-c2cnn(C)c2)nc(-c2cncn2C)n1
InChIInChI=1S/C14H17N7/c1-4-16-13-5-11(10-6-17-21(3)8-10)18-14(19-13)12-7-15-9-20(12)2/h5-9H,4H2,1-3H3,(H,16,18,19)
InChIKeyQTKNSNOYIQFKTK-UHFFFAOYSA-N
XLogP1.71
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-ethyl-6-(1-methylpyrazol-4-yl)-2-pyrimidin-4-ylpyrimidin-4-amine
CID 106715921
N-ethyl-6-(1-methylpyrazol-4-yl)-2-propylpyrimidin-4-amine
CID 80945798
[2-(3-ethylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-yl]hydrazine
CID 106716226
2-(5-chloro-1,3-thiazol-2-yl)-N-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 107125410
2-(3-ethylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 106716060
[2-(1-methylpyrazol-3-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-yl]hydrazine
CID 106716205
2-tert-butyl-6-(1-methylpyrazol-4-yl)-N-propylpyrimidin-4-amine
CID 80953067
[2-(3-methylimidazol-4-yl)-6-propylpyrimidin-4-yl]hydrazine
CID 66117477
[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine
CID 106716187
[6-(1-methylpyrazol-4-yl)-2-pyrazin-2-ylpyrimidin-4-yl]hydrazine
CID 106716096
N-ethyl-2-(2-methylpyrazol-3-yl)-6-phenylpyrimidin-4-amine
CID 114554308
N,6-diethyl-5-methyl-2-(3-methylimidazol-4-yl)pyrimidin-4-amine
CID 66117684

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine (CID 106715906) is N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine is CCNc1cc(-c2cnn(C)c2)nc(-c2cncn2C)n1.
What is the InChIKey of N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The InChIKey is QTKNSNOYIQFKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-4-16-13-5-11(10-6-17-21(3)8-10)18-14(19-13)12-7-15-9-20(12)2/h5-9H,4H2,1-3H3,(H,16,18,19).
What are the key properties of N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine has a molecular weight of 283.34 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methylimidazol-4-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 106715906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).