[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol

C10H13IN2O — CID 68796392

IUPAC[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1c1ccc(I)cn1
InChIInChI=1S/C10H13IN2O/c11-8-3-4-10(12-6-8)13-5-1-2-9(13)7-14/h3-4,6,9,14H,1-2,5,7H2
InChIKeyLHEAKSHCZIZHBA-UHFFFAOYSA-N
MW304.13 g/mol
LogP1.65
Rot. Bonds2

About [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol

[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol (PubChem CID 68796392) has the molecular formula C10H13IN2O and a molecular weight of 304.13 g/mol. Its IUPAC name is [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol
PubChem CID68796392
Molecular FormulaC10H13IN2O
Molecular Weight304.13 g/mol
Exact Mass304.01
IUPAC Name[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1c1ccc(I)cn1
InChIInChI=1S/C10H13IN2O/c11-8-3-4-10(12-6-8)13-5-1-2-9(13)7-14/h3-4,6,9,14H,1-2,5,7H2
InChIKeyLHEAKSHCZIZHBA-UHFFFAOYSA-N
XLogP1.65
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.13
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-(5-fluoro-2-pyridinyl)pyrrolidin-2-yl]methanol
CID 61409466
[(2S)-1-(5-methoxy-2-pyridinyl)pyrrolidin-2-yl]methanol
CID 139294140
[1-(5-tert-butyl-2-pyridinyl)piperidin-2-yl]methanol
CID 107875282
6-[2-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboximidamide
CID 61406687
6-[2-(hydroxymethyl)azepan-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 116637062
[1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 62770947
(1-pyridazin-3-ylpyrrolidin-2-yl)methanol
CID 62482647
[(2S)-1-[5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrrolidin-2-yl]methanol
CID 45249597
6-(2-ethylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 60974707
[1-[6-(hydroxymethyl)pyridazin-3-yl]piperidin-2-yl]methanol
CID 61407734
[1-(6-aminopyrazin-2-yl)pyrrolidin-2-yl]methanol
CID 79033972
[1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidin-2-yl]methanol
CID 80629858

Frequently Asked Questions

What is the IUPAC name of [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol (CID 68796392) is [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol is OCC1CCCN1c1ccc(I)cn1.
What is the InChIKey of [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol?
The InChIKey is LHEAKSHCZIZHBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13IN2O/c11-8-3-4-10(12-6-8)13-5-1-2-9(13)7-14/h3-4,6,9,14H,1-2,5,7H2.
What are the key properties of [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol?
[1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol has a molecular weight of 304.13 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-iodo-2-pyridinyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 68796392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).