[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol

C10H14BrNO2 — CID 66261469

IUPAC[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1Cc1ccc(Br)o1
InChIInChI=1S/C10H14BrNO2/c11-10-4-3-9(14-10)6-12-5-1-2-8(12)7-13/h3-4,8,13H,1-2,5-7H2/t8-/m1/s1
InChIKeyFDTFKPZFTICCDE-MRVPVSSYSA-N
MW260.13 g/mol
LogP2.00
Rot. Bonds3

About [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol

[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 66261469) has the molecular formula C10H14BrNO2 and a molecular weight of 260.13 g/mol. Its IUPAC name is [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol
PubChem CID66261469
Molecular FormulaC10H14BrNO2
Molecular Weight260.13 g/mol
Exact Mass259.02
IUPAC Name[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1Cc1ccc(Br)o1
InChIInChI=1S/C10H14BrNO2/c11-10-4-3-9(14-10)6-12-5-1-2-8(12)7-13/h3-4,8,13H,1-2,5-7H2/t8-/m1/s1
InChIKeyFDTFKPZFTICCDE-MRVPVSSYSA-N
XLogP2.00
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol (CID 66261469) is [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol is OC[C@H]1CCCN1Cc1ccc(Br)o1.
What is the InChIKey of [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is FDTFKPZFTICCDE-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14BrNO2/c11-10-4-3-9(14-10)6-12-5-1-2-8(12)7-13/h3-4,8,13H,1-2,5-7H2/t8-/m1/s1.
What are the key properties of [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol?
[(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 260.13 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[(5-bromofuran-2-yl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 66261469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).