(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol

C10H19IO2 — CID 10851587

IUPAC(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol
SMILESCCCC[C@@H](O)[C@H]1CC[C@H](CI)O1
InChIInChI=1S/C10H19IO2/c1-2-3-4-9(12)10-6-5-8(7-11)13-10/h8-10,12H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKeyZCNVURLIRFMBHK-OPRDCNLKSA-N
MW298.16 g/mol
LogP2.52
Rot. Bonds5

About (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol

(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol (PubChem CID 10851587) has the molecular formula C10H19IO2 and a molecular weight of 298.16 g/mol. Its IUPAC name is (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol.

Molecular Properties

Compound Name(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol
PubChem CID10851587
Molecular FormulaC10H19IO2
Molecular Weight298.16 g/mol
Exact Mass298.04
IUPAC Name(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol
SMILESCCCC[C@@H](O)[C@H]1CC[C@H](CI)O1
InChIInChI=1S/C10H19IO2/c1-2-3-4-9(12)10-6-5-8(7-11)13-10/h8-10,12H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKeyZCNVURLIRFMBHK-OPRDCNLKSA-N
XLogP2.52
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.16
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-[(2S,5R)-5-[(1S)-1-hydroxypentyl]oxolan-2-yl]pentan-1-ol
CID 101238341
1-(5-ethyloxolan-2-yl)tridecan-1-ol
CID 20670075
1-(5-methyloxolan-2-yl)pentan-1-ol
CID 82837329
(1S,4S)-1-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]-4-[(2S,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]butane-1,4-diol
CID 11988735
(1S)-1-[(2S,5R)-5-[(2S,5R)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]undecan-1-ol
CID 11533144
methyl 9-hydroxy-9-(5-pentyloxolan-2-yl)nonanoate
CID 54270622
5-(1-hydroxyhexyl)oxolane-2-carboxamide
CID 86258242
(1R)-1-[(2R,5R)-5-(phenylmethoxymethyl)oxolan-2-yl]undecan-1-ol
CID 11545059
1-(5-methyloxolan-2-yl)butan-1-ol
CID 82837669
1-cyclopropylpentan-1-ol
CID 551238
2-ethyl-5-(iodomethyl)oxolane
CID 130582736
(1S,4S)-1,4-bis[(2S,5R)-5-[(1S)-1,2-dihydroxyethyl]oxolan-2-yl]butane-1,4-diol
CID 25228527

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol?
The IUPAC name of (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol (CID 10851587) is (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol.
What is the SMILES notation for (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol?
The canonical SMILES for (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol is CCCC[C@@H](O)[C@H]1CC[C@H](CI)O1.
What is the InChIKey of (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol?
The InChIKey is ZCNVURLIRFMBHK-OPRDCNLKSA-N. The full InChI is InChI=1S/C10H19IO2/c1-2-3-4-9(12)10-6-5-8(7-11)13-10/h8-10,12H,2-7H2,1H3/t8-,9-,10-/m1/s1.
What are the key properties of (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol?
(1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol has a molecular weight of 298.16 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(2R,5R)-5-(iodomethyl)oxolan-2-yl]pentan-1-ol is sourced from PubChem (CID 10851587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).