6-ethyl-2-methyl-7H-purine

C8H10N4 — CID 176927465

IUPAC6-ethyl-2-methyl-7H-purine
SMILESCCc1nc(C)nc2nc[nH]c12
InChIInChI=1S/C8H10N4/c1-3-6-7-8(10-4-9-7)12-5(2)11-6/h4H,3H2,1-2H3,(H,9,10,11,12)
InChIKeyUNYGBWWKOUNWLU-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.22
Rot. Bonds1

About 6-ethyl-2-methyl-7H-purine

6-ethyl-2-methyl-7H-purine (PubChem CID 176927465) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 6-ethyl-2-methyl-7H-purine.

Molecular Properties

Compound Name6-ethyl-2-methyl-7H-purine
PubChem CID176927465
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name6-ethyl-2-methyl-7H-purine
SMILESCCc1nc(C)nc2nc[nH]c12
InChIInChI=1S/C8H10N4/c1-3-6-7-8(10-4-9-7)12-5(2)11-6/h4H,3H2,1-2H3,(H,9,10,11,12)
InChIKeyUNYGBWWKOUNWLU-UHFFFAOYSA-N
XLogP1.22
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-butan-2-yl]-2-methyl-7H-purin-6-amine
CID 67967892
(2-methyl-7H-purin-6-yl)azanide;tungsten
CID 58774197
ethane;6-ethyl-7H-purine;molecular hydrogen
CID 143569207
bis(2-methyl-7H-purin-6-amine);sulfuric acid
CID 118855862
2-ethyl-7H-purin-6-amine
CID 19795383
N-[(E)-but-2-enyl]-2-methyl-7H-purin-6-amine
CID 154596530
5-chloro-7-ethyl-1H-imidazo[4,5-b]pyridine
CID 177331332
2-ethoxy-6-methyl-7H-purine
CID 119081784
2-(1-ethoxypropyl)-7H-purin-6-amine
CID 174819126
5,6-diethyl-1H-imidazo[4,5-b]pyridine
CID 89128817
(2-amino-7H-purin-6-yl)methanol
CID 11593490
2-methyl-N-[(5-methylfuran-2-yl)methyl]-7H-purin-6-amine
CID 154596531

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-7H-purine?
The IUPAC name of 6-ethyl-2-methyl-7H-purine (CID 176927465) is 6-ethyl-2-methyl-7H-purine.
What is the SMILES notation for 6-ethyl-2-methyl-7H-purine?
The canonical SMILES for 6-ethyl-2-methyl-7H-purine is CCc1nc(C)nc2nc[nH]c12.
What is the InChIKey of 6-ethyl-2-methyl-7H-purine?
The InChIKey is UNYGBWWKOUNWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-3-6-7-8(10-4-9-7)12-5(2)11-6/h4H,3H2,1-2H3,(H,9,10,11,12).
What are the key properties of 6-ethyl-2-methyl-7H-purine?
6-ethyl-2-methyl-7H-purine has a molecular weight of 162.20 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-7H-purine is sourced from PubChem (CID 176927465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).