2-(2-methoxyethyl)-7H-purin-8-amine

C8H11N5O — CID 150775461

IUPAC2-(2-methoxyethyl)-7H-purin-8-amine
SMILESCOCCc1ncc2[nH]c(N)nc2n1
InChIInChI=1S/C8H11N5O/c1-14-3-2-6-10-4-5-7(12-6)13-8(9)11-5/h4H,2-3H2,1H3,(H3,9,10,11,12,13)
InChIKeyKATSTVHRHXFISP-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.12
Rot. Bonds3

About 2-(2-methoxyethyl)-7H-purin-8-amine

2-(2-methoxyethyl)-7H-purin-8-amine (PubChem CID 150775461) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-7H-purin-8-amine.

Molecular Properties

Compound Name2-(2-methoxyethyl)-7H-purin-8-amine
PubChem CID150775461
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name2-(2-methoxyethyl)-7H-purin-8-amine
SMILESCOCCc1ncc2[nH]c(N)nc2n1
InChIInChI=1S/C8H11N5O/c1-14-3-2-6-10-4-5-7(12-6)13-8(9)11-5/h4H,2-3H2,1H3,(H3,9,10,11,12,13)
InChIKeyKATSTVHRHXFISP-UHFFFAOYSA-N
XLogP0.12
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-fluoro-7H-purin-8-amine
CID 142660293
2-phenylmethoxy-7H-purin-8-amine
CID 130154734
N-methyl-2-propyl-7H-purin-8-amine
CID 175456681
S-[2-(2-aminoethyl)-7H-purin-8-yl]thiohydroxylamine
CID 54210546
2-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821394
5-bromo-2-(2-methoxyethyl)-N-propylpyrimidin-4-amine
CID 66304100
5-(aminomethyl)-2-(3-methoxypropyl)pyrimidin-4-amine
CID 65093955
8-methylsulfanyl-7H-purine;7H-purin-8-amine
CID 159657386
2-propyl-7H-purine;hydrochloride
CID 18353371
2,4-bis(2-methoxyethyl)pyrimidine
CID 174836180
4-chloro-2-(2-methoxyethyl)pyrimidine-5-carboxylic acid
CID 117225342
4-methoxy-2-(2-methoxyethyl)pyrimidine
CID 174759765

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-7H-purin-8-amine?
The IUPAC name of 2-(2-methoxyethyl)-7H-purin-8-amine (CID 150775461) is 2-(2-methoxyethyl)-7H-purin-8-amine.
What is the SMILES notation for 2-(2-methoxyethyl)-7H-purin-8-amine?
The canonical SMILES for 2-(2-methoxyethyl)-7H-purin-8-amine is COCCc1ncc2[nH]c(N)nc2n1.
What is the InChIKey of 2-(2-methoxyethyl)-7H-purin-8-amine?
The InChIKey is KATSTVHRHXFISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-14-3-2-6-10-4-5-7(12-6)13-8(9)11-5/h4H,2-3H2,1H3,(H3,9,10,11,12,13).
What are the key properties of 2-(2-methoxyethyl)-7H-purin-8-amine?
2-(2-methoxyethyl)-7H-purin-8-amine has a molecular weight of 193.21 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-7H-purin-8-amine is sourced from PubChem (CID 150775461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).