6-imidazol-1-yl-2-methylpyrimidin-4-amine

C8H9N5 — CID 80854231

IUPAC6-imidazol-1-yl-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc(-n2ccnc2)n1
InChIInChI=1S/C8H9N5/c1-6-11-7(9)4-8(12-6)13-3-2-10-5-13/h2-5H,1H3,(H2,9,11,12)
InChIKeyRCGQOOZYYPJUFO-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.55
Rot. Bonds1

About 6-imidazol-1-yl-2-methylpyrimidin-4-amine

6-imidazol-1-yl-2-methylpyrimidin-4-amine (PubChem CID 80854231) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is 6-imidazol-1-yl-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-imidazol-1-yl-2-methylpyrimidin-4-amine
PubChem CID80854231
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC Name6-imidazol-1-yl-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc(-n2ccnc2)n1
InChIInChI=1S/C8H9N5/c1-6-11-7(9)4-8(12-6)13-3-2-10-5-13/h2-5H,1H3,(H2,9,11,12)
InChIKeyRCGQOOZYYPJUFO-UHFFFAOYSA-N
XLogP0.55
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-imidazol-1-yl-2-methyl-6-piperidin-4-ylpyrimidine;dihydrochloride
CID 171687273
4-hydrazinyl-6-imidazol-1-ylpyrimidin-2-amine
CID 80900802
2-amino-4-imidazol-1-yl-1H-pyrimidin-6-one
CID 136776207
(6-imidazol-1-yl-2-methylsulfanylpyrimidin-4-yl)hydrazine
CID 80899902
N-[4-(6-imidazol-1-yl-2-methylpyrimidin-4-yl)oxyphenyl]acetamide
CID 122312969
2-methyl-6-(3-propan-2-ylpyrazol-1-yl)pyrimidin-4-amine
CID 80857482
4-chloro-6-imidazol-1-yl-2-methylsulfanylpyrimidine;ethane
CID 142040016
4-imidazol-1-yl-2-methyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine
CID 56700168
N-[4-[(6-imidazol-1-yl-2-methylpyrimidin-4-yl)amino]phenyl]propanamide
CID 70702579
4-imidazol-1-yl-2,6-di(propan-2-yl)pyrimidine
CID 133407803
6-imidazol-1-yl-4-(2-methylphenyl)pyridin-3-amine
CID 22992330
1-(6-amino-2-methylpyrimidin-4-yl)pyrazole-3-carboxamide
CID 80867928

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-2-methylpyrimidin-4-amine?
The IUPAC name of 6-imidazol-1-yl-2-methylpyrimidin-4-amine (CID 80854231) is 6-imidazol-1-yl-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-imidazol-1-yl-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-imidazol-1-yl-2-methylpyrimidin-4-amine is Cc1nc(N)cc(-n2ccnc2)n1.
What is the InChIKey of 6-imidazol-1-yl-2-methylpyrimidin-4-amine?
The InChIKey is RCGQOOZYYPJUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-6-11-7(9)4-8(12-6)13-3-2-10-5-13/h2-5H,1H3,(H2,9,11,12).
What are the key properties of 6-imidazol-1-yl-2-methylpyrimidin-4-amine?
6-imidazol-1-yl-2-methylpyrimidin-4-amine has a molecular weight of 175.19 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-2-methylpyrimidin-4-amine is sourced from PubChem (CID 80854231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).