2-chloro-5-(iodomethyl)pyridine

C6H5ClIN — CID 11149463

IUPAC2-chloro-5-(iodomethyl)pyridine
SMILESClc1ccc(CI)cn1
InChIInChI=1S/C6H5ClIN/c7-6-2-1-5(3-8)4-9-6/h1-2,4H,3H2
InChIKeySFHWEYFDHRIONH-UHFFFAOYSA-N
MW253.47 g/mol
LogP2.67
Rot. Bonds1

About 2-chloro-5-(iodomethyl)pyridine

2-chloro-5-(iodomethyl)pyridine (PubChem CID 11149463) has the molecular formula C6H5ClIN and a molecular weight of 253.47 g/mol. Its IUPAC name is 2-chloro-5-(iodomethyl)pyridine.

Molecular Properties

Compound Name2-chloro-5-(iodomethyl)pyridine
PubChem CID11149463
Molecular FormulaC6H5ClIN
Molecular Weight253.47 g/mol
Exact Mass252.92
IUPAC Name2-chloro-5-(iodomethyl)pyridine
SMILESClc1ccc(CI)cn1
InChIInChI=1S/C6H5ClIN/c7-6-2-1-5(3-8)4-9-6/h1-2,4H,3H2
InChIKeySFHWEYFDHRIONH-UHFFFAOYSA-N
XLogP2.67
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.47
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-(6-chloro-3-pyridinyl)-N,N-dimethylmethanamine
CID 12056677
2-chloro-5-(methoxymethyl)pyridine
CID 19010921
(6-chloro-3-pyridinyl)methylhydrazine;hydrochloride
CID 53229944
3-(6-chloro-3-pyridinyl)propan-1-amine
CID 55266359
S-[(6-chloro-3-pyridinyl)methyl] ethanethioate
CID 6420468
2-chloro-5-(1,2,4-triazol-4-ylmethyl)pyridine
CID 178122205
1,6-bis(6-chloro-3-pyridinyl)hexane-2,5-diamine
CID 18365459
N-[2-(6-chloro-3-pyridinyl)ethyl]methanimine
CID 174856030
(6-chloro-3-pyridinyl)methyl cyanate
CID 171428640
2-chloro-5-[(2S)-2-methylbutyl]pyridine
CID 56840075
2-chloro-5-[(6-methoxy-3-pyridinyl)methyl]pyridine
CID 139512366
2-chloro-5-(chloromethyl)pyridine;pyridine
CID 90098666

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(iodomethyl)pyridine?
The IUPAC name of 2-chloro-5-(iodomethyl)pyridine (CID 11149463) is 2-chloro-5-(iodomethyl)pyridine.
What is the SMILES notation for 2-chloro-5-(iodomethyl)pyridine?
The canonical SMILES for 2-chloro-5-(iodomethyl)pyridine is Clc1ccc(CI)cn1.
What is the InChIKey of 2-chloro-5-(iodomethyl)pyridine?
The InChIKey is SFHWEYFDHRIONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClIN/c7-6-2-1-5(3-8)4-9-6/h1-2,4H,3H2.
What are the key properties of 2-chloro-5-(iodomethyl)pyridine?
2-chloro-5-(iodomethyl)pyridine has a molecular weight of 253.47 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(iodomethyl)pyridine is sourced from PubChem (CID 11149463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).