[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol

C10H13N5O2 — CID 67674547

IUPAC[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol
SMILESNc1nc(C2CC[C@@H](CO)O2)nc2nc[nH]c12
InChIInChI=1S/C10H13N5O2/c11-8-7-10(13-4-12-7)15-9(14-8)6-2-1-5(3-16)17-6/h4-6,16H,1-3H2,(H3,11,12,13,14,15)/t5-,6?/m0/s1
InChIKeyOSGVZPMUZPCSSG-ZBHICJROSA-N
MW235.25 g/mol
LogP0.15
Rot. Bonds2

About [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol

[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol (PubChem CID 67674547) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol
PubChem CID67674547
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol
SMILESNc1nc(C2CC[C@@H](CO)O2)nc2nc[nH]c12
InChIInChI=1S/C10H13N5O2/c11-8-7-10(13-4-12-7)15-9(14-8)6-2-1-5(3-16)17-6/h4-6,16H,1-3H2,(H3,11,12,13,14,15)/t5-,6?/m0/s1
InChIKeyOSGVZPMUZPCSSG-ZBHICJROSA-N
XLogP0.15
TPSA109.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol?
The IUPAC name of [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol (CID 67674547) is [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol.
What is the SMILES notation for [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol?
The canonical SMILES for [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol is Nc1nc(C2CC[C@@H](CO)O2)nc2nc[nH]c12.
What is the InChIKey of [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol?
The InChIKey is OSGVZPMUZPCSSG-ZBHICJROSA-N. The full InChI is InChI=1S/C10H13N5O2/c11-8-7-10(13-4-12-7)15-9(14-8)6-2-1-5(3-16)17-6/h4-6,16H,1-3H2,(H3,11,12,13,14,15)/t5-,6?/m0/s1.
What are the key properties of [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol?
[(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol has a molecular weight of 235.25 g/mol, XLogP of 0.15, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-5-(6-amino-7H-purin-2-yl)oxolan-2-yl]methanol is sourced from PubChem (CID 67674547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).