2-(1-ethylimidazol-2-yl)pyrimidin-4-amine

C9H11N5 — CID 116795267

IUPAC2-(1-ethylimidazol-2-yl)pyrimidin-4-amine
SMILESCCn1ccnc1-c1nccc(N)n1
InChIInChI=1S/C9H11N5/c1-2-14-6-5-12-9(14)8-11-4-3-7(10)13-8/h3-6H,2H2,1H3,(H2,10,11,13)
InChIKeyCHUXGGDXDAZTKN-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.94
Rot. Bonds2

About 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine

2-(1-ethylimidazol-2-yl)pyrimidin-4-amine (PubChem CID 116795267) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)pyrimidin-4-amine
PubChem CID116795267
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name2-(1-ethylimidazol-2-yl)pyrimidin-4-amine
SMILESCCn1ccnc1-c1nccc(N)n1
InChIInChI=1S/C9H11N5/c1-2-14-6-5-12-9(14)8-11-4-3-7(10)13-8/h3-6H,2H2,1H3,(H2,10,11,13)
InChIKeyCHUXGGDXDAZTKN-UHFFFAOYSA-N
XLogP0.94
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1-ethylimidazol-2-yl)-6-methylpyridin-2-amine
CID 79048986
2-[(1-ethylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 116795282
2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
CID 70011500
3-(1-ethylimidazol-2-yl)-4-methylaniline
CID 63974560
2-(1-ethylimidazol-4-yl)pyrimidin-4-amine
CID 130509154
2-cyclopropyl-6-(1-ethylimidazol-2-yl)pyrimidin-4-amine
CID 80952857
3-(1-ethylimidazol-2-yl)-4-fluoroaniline
CID 104781192
2-(1-ethylimidazol-2-yl)-6-fluoroaniline
CID 107602831
2-(1-ethylimidazol-2-yl)-5-fluoroaniline
CID 107626587
4-[2-(1-ethylimidazol-2-yl)ethyl]pyridin-2-amine
CID 79760806
1-ethyl-2-(2-methylphenyl)imidazole
CID 110540780
2-[3-[1-[2-(4-methyltriazol-1-yl)ethyl]imidazol-2-yl]phenyl]pyrimidin-4-amine
CID 165428599

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine (CID 116795267) is 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine is CCn1ccnc1-c1nccc(N)n1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine?
The InChIKey is CHUXGGDXDAZTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-2-14-6-5-12-9(14)8-11-4-3-7(10)13-8/h3-6H,2H2,1H3,(H2,10,11,13).
What are the key properties of 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine?
2-(1-ethylimidazol-2-yl)pyrimidin-4-amine has a molecular weight of 189.22 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 116795267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).