[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol

C17H25NO2 — CID 100647084

IUPAC[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol
SMILESOC[C@]1(N[C@@H]2CC[C@H](Cc3ccccc3)C2)CCOC1
InChIInChI=1S/C17H25NO2/c19-12-17(8-9-20-13-17)18-16-7-6-15(11-16)10-14-4-2-1-3-5-14/h1-5,15-16,18-19H,6-13H2/t15-,16-,17-/m1/s1
InChIKeyVQFKFJKDDCZQBN-BRWVUGGUSA-N
MW275.39 g/mol
LogP2.14
Rot. Bonds5

About [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol

[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol (PubChem CID 100647084) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol
PubChem CID100647084
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol
SMILESOC[C@]1(N[C@@H]2CC[C@H](Cc3ccccc3)C2)CCOC1
InChIInChI=1S/C17H25NO2/c19-12-17(8-9-20-13-17)18-16-7-6-15(11-16)10-14-4-2-1-3-5-14/h1-5,15-16,18-19H,6-13H2/t15-,16-,17-/m1/s1
InChIKeyVQFKFJKDDCZQBN-BRWVUGGUSA-N
XLogP2.14
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol?
The IUPAC name of [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol (CID 100647084) is [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol.
What is the SMILES notation for [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol?
The canonical SMILES for [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol is OC[C@]1(N[C@@H]2CC[C@H](Cc3ccccc3)C2)CCOC1.
What is the InChIKey of [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol?
The InChIKey is VQFKFJKDDCZQBN-BRWVUGGUSA-N. The full InChI is InChI=1S/C17H25NO2/c19-12-17(8-9-20-13-17)18-16-7-6-15(11-16)10-14-4-2-1-3-5-14/h1-5,15-16,18-19H,6-13H2/t15-,16-,17-/m1/s1.
What are the key properties of [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol?
[(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol has a molecular weight of 275.39 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-[[(1R,3R)-3-benzylcyclopentyl]amino]oxolan-3-yl]methanol is sourced from PubChem (CID 100647084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).