[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol

C14H15N5O2 — CID 59835024

IUPAC[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1c1nc(-c2ccco2)c2[nH]cnc2n1
InChIInChI=1S/C14H15N5O2/c20-7-9-3-1-5-19(9)14-17-11(10-4-2-6-21-10)12-13(18-14)16-8-15-12/h2,4,6,8-9,20H,1,3,5,7H2,(H,15,16,17,18)/t9-/m1/s1
InChIKeyXDKHXKXEVNAPBG-SECBINFHSA-N
MW285.31 g/mol
LogP1.57
Rot. Bonds3

About [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol

[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol (PubChem CID 59835024) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol
PubChem CID59835024
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1c1nc(-c2ccco2)c2[nH]cnc2n1
InChIInChI=1S/C14H15N5O2/c20-7-9-3-1-5-19(9)14-17-11(10-4-2-6-21-10)12-13(18-14)16-8-15-12/h2,4,6,8-9,20H,1,3,5,7H2,(H,15,16,17,18)/t9-/m1/s1
InChIKeyXDKHXKXEVNAPBG-SECBINFHSA-N
XLogP1.57
TPSA91.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol (CID 59835024) is [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol is OC[C@H]1CCCN1c1nc(-c2ccco2)c2[nH]cnc2n1.
What is the InChIKey of [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol?
The InChIKey is XDKHXKXEVNAPBG-SECBINFHSA-N. The full InChI is InChI=1S/C14H15N5O2/c20-7-9-3-1-5-19(9)14-17-11(10-4-2-6-21-10)12-13(18-14)16-8-15-12/h2,4,6,8-9,20H,1,3,5,7H2,(H,15,16,17,18)/t9-/m1/s1.
What are the key properties of [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol?
[(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol has a molecular weight of 285.31 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[6-(furan-2-yl)-7H-purin-2-yl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 59835024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).