2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine

C10H14ClNO — CID 62239361

IUPAC2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine
SMILESCC(C)(C)Oc1cccc(CCl)n1
InChIInChI=1S/C10H14ClNO/c1-10(2,3)13-9-6-4-5-8(7-11)12-9/h4-6H,7H2,1-3H3
InChIKeyRZTDOXMYXZBOJT-UHFFFAOYSA-N
MW199.68 g/mol
LogP3.00
Rot. Bonds2

About 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine

2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine (PubChem CID 62239361) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine.

Molecular Properties

Compound Name2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine
PubChem CID62239361
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine
SMILESCC(C)(C)Oc1cccc(CCl)n1
InChIInChI=1S/C10H14ClNO/c1-10(2,3)13-9-6-4-5-8(7-11)12-9/h4-6H,7H2,1-3H3
InChIKeyRZTDOXMYXZBOJT-UHFFFAOYSA-N
XLogP3.00
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Chloro-6-ethoxypyridine
CID 98563
2-Methoxy-6-methylpyridine
CID 5324773
2-tert-Butoxy-6-chloropyridine
CID 11984350
2-Methyl-6-phenylmethoxypyridine
CID 261829
Pyridine, 2-ethoxy-6-methyl-
CID 4738465
2-Ethynyl-6-methoxypyridine
CID 9877376
(6-(Tert-butoxy)pyridin-2-yl)methanamine
CID 62290744
3-(Chloromethyl)-6-methoxy-2-methylpyridine
CID 11206034
2-Chloro-6-isopropoxypyridine
CID 13309095
2-(Chloromethyl)-6-methoxypyridine
CID 17854228
3-(Chloromethyl)-2-methoxy-6-(trifluoromethyl)pyridine
CID 59834819
2-(Benzyloxy)-3-(chloromethyl)-4,6-dimethylpyridine
CID 61257868

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine?
The IUPAC name of 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine (CID 62239361) is 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine.
What is the SMILES notation for 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine?
The canonical SMILES for 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine is CC(C)(C)Oc1cccc(CCl)n1.
What is the InChIKey of 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine?
The InChIKey is RZTDOXMYXZBOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO/c1-10(2,3)13-9-6-4-5-8(7-11)12-9/h4-6H,7H2,1-3H3.
What are the key properties of 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine?
2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine has a molecular weight of 199.68 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy]pyridine is sourced from PubChem (CID 62239361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).