(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol

C11H15N5O3 — CID 90728426

IUPAC(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol
SMILESCOc1nc2c(N)ncnc2n1[C@H]1C[C@H](O)[C@@H](C)O1
InChIInChI=1S/C11H15N5O3/c1-5-6(17)3-7(19-5)16-10-8(15-11(16)18-2)9(12)13-4-14-10/h4-7,17H,3H2,1-2H3,(H2,12,13,14)/t5-,6+,7-/m1/s1
InChIKeyZYEUAPUPTRUSAY-DSYKOEDSSA-N
MW265.27 g/mol
LogP0.09
Rot. Bonds2

About (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol

(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol (PubChem CID 90728426) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol.

Molecular Properties

Compound Name(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol
PubChem CID90728426
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol
SMILESCOc1nc2c(N)ncnc2n1[C@H]1C[C@H](O)[C@@H](C)O1
InChIInChI=1S/C11H15N5O3/c1-5-6(17)3-7(19-5)16-10-8(15-11(16)18-2)9(12)13-4-14-10/h4-7,17H,3H2,1-2H3,(H2,12,13,14)/t5-,6+,7-/m1/s1
InChIKeyZYEUAPUPTRUSAY-DSYKOEDSSA-N
XLogP0.09
TPSA108.31 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,5R)-5-(6-amino-8-phenylmethoxypurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
CID 163296362
7-amino-13-hydroxy-15-oxa-2,4,6,9-tetrazatetracyclo[10.2.1.02,10.03,8]pentadeca-3,5,7,9-tetraen-11-one
CID 155887050
(2R,3S,5S)-5-(6-amino-8-bromopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
CID 42531062
(2R,3S,5R)-5-(6-amino-8-pentylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
CID 512596
bis[[5-[6-amino-8-(propan-2-ylamino)purin-9-yl]-4-hydroxyoxolan-2-yl]oxy]-hydroxy-methoxyphosphanium
CID 176620392
N-[(2R,3R,4S,5R)-2-(6-amino-8-methoxypurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]benzamide
CID 10408674
(2R,3S,5R)-5-[6-amino-8-(2-trimethylsilylethylsulfanyl)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol
CID 10833864
sodium [(2R,3S,5R)-5-(6-amino-8-bromopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate
CID 24824598
(2R,3S,5R)-5-(6-chloropurin-9-yl)-2-methyloxolan-3-ol
CID 10706154
[(2S,5R)-5-(6-amino-8-bromopurin-9-yl)-4-hydroxyoxolan-2-yl]methyl methyl hydrogen phosphate
CID 153438407
[(2S,5R)-5-aminooxolan-2-yl]methyl propan-2-yl hydrogen phosphate;(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol
CID 138857899
[(2R,5R)-5-(6-amino-8-bromopurin-9-yl)-4-hydroxyoxolan-2-yl]oxy methyl hydrogen phosphate
CID 140738377

Frequently Asked Questions

What is the IUPAC name of (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol?
The IUPAC name of (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol (CID 90728426) is (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol.
What is the SMILES notation for (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol?
The canonical SMILES for (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol is COc1nc2c(N)ncnc2n1[C@H]1C[C@H](O)[C@@H](C)O1.
What is the InChIKey of (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol?
The InChIKey is ZYEUAPUPTRUSAY-DSYKOEDSSA-N. The full InChI is InChI=1S/C11H15N5O3/c1-5-6(17)3-7(19-5)16-10-8(15-11(16)18-2)9(12)13-4-14-10/h4-7,17H,3H2,1-2H3,(H2,12,13,14)/t5-,6+,7-/m1/s1.
What are the key properties of (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol?
(2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol has a molecular weight of 265.27 g/mol, XLogP of 0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S,5R)-5-(6-amino-8-methoxypurin-9-yl)-2-methyloxolan-3-ol is sourced from PubChem (CID 90728426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).