3-chloro-2-methylpyridine;formaldehyde

C7H8ClNO — CID 175449044

IUPAC3-chloro-2-methylpyridine;formaldehyde
SMILESC=O.Cc1ncccc1Cl
InChIInChI=1S/C6H6ClN.CH2O/c1-5-6(7)3-2-4-8-5;1-2/h2-4H,1H3;1H2
InChIKeyCXGBYTSZDLYFJL-UHFFFAOYSA-N
MW157.60 g/mol
LogP1.86
Rot. Bonds

About 3-chloro-2-methylpyridine;formaldehyde

3-chloro-2-methylpyridine;formaldehyde (PubChem CID 175449044) has the molecular formula C7H8ClNO and a molecular weight of 157.60 g/mol. Its IUPAC name is 3-chloro-2-methylpyridine;formaldehyde.

Molecular Properties

Compound Name3-chloro-2-methylpyridine;formaldehyde
PubChem CID175449044
Molecular FormulaC7H8ClNO
Molecular Weight157.60 g/mol
Exact Mass157.03
IUPAC Name3-chloro-2-methylpyridine;formaldehyde
SMILESC=O.Cc1ncccc1Cl
InChIInChI=1S/C6H6ClN.CH2O/c1-5-6(7)3-2-4-8-5;1-2/h2-4H,1H3;1H2
InChIKeyCXGBYTSZDLYFJL-UHFFFAOYSA-N
XLogP1.86
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.60
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-methylpyridine;dichloromethane
CID 174920232
3-(3-chloro-2-pyridinyl)prop-2-enal
CID 169458667
3-chloro-2-(3-chloro-2-pyridinyl)pyridine;palladium(2+)
CID 18935247
azane;2,3-dichloropyridine
CID 174689212
bis(2,3-dimethylpyridine);ethane
CID 159594018
4-chloro-2-methylpyridine-3-sulfonyl chloride
CID 151415584
2-bromo-3-methylpyridine;3-chloro-2-methylpyridine;2-methyl-3-(trifluoromethyl)pyridine
CID 157346640
1,3-dichloro-2-methylbenzene;bis(2,3-dimethylpyridine);1-fluoro-2-methylbenzene
CID 158361621
2-methylpyridine-3-carbonyl chloride;hydrochloride
CID 18321920
2-(2,6-dichlorophenyl)-3-methylpyridine
CID 118841939
(2-methyl-3-pyridinyl) methanesulfonate
CID 119084020
3-(3-chloro-2-nitrophenoxy)-2-methylpyridine
CID 104835444

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-methylpyridine;formaldehyde?
The IUPAC name of 3-chloro-2-methylpyridine;formaldehyde (CID 175449044) is 3-chloro-2-methylpyridine;formaldehyde.
What is the SMILES notation for 3-chloro-2-methylpyridine;formaldehyde?
The canonical SMILES for 3-chloro-2-methylpyridine;formaldehyde is C=O.Cc1ncccc1Cl.
What is the InChIKey of 3-chloro-2-methylpyridine;formaldehyde?
The InChIKey is CXGBYTSZDLYFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClN.CH2O/c1-5-6(7)3-2-4-8-5;1-2/h2-4H,1H3;1H2.
What are the key properties of 3-chloro-2-methylpyridine;formaldehyde?
3-chloro-2-methylpyridine;formaldehyde has a molecular weight of 157.60 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-methylpyridine;formaldehyde is sourced from PubChem (CID 175449044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).