(2,4-dichloro-6-methyl-3-pyridinyl)methanol

C7H7Cl2NO — CID 9267100

IUPAC(2,4-dichloro-6-methyl-3-pyridinyl)methanol
SMILESCc1cc(Cl)c(CO)c(Cl)n1
InChIInChI=1S/C7H7Cl2NO/c1-4-2-6(8)5(3-11)7(9)10-4/h2,11H,3H2,1H3
InChIKeyYYRIQTLBJWWQMZ-UHFFFAOYSA-N
MW192.04 g/mol
LogP2.19
Rot. Bonds1

About (2,4-dichloro-6-methyl-3-pyridinyl)methanol

(2,4-dichloro-6-methyl-3-pyridinyl)methanol (PubChem CID 9267100) has the molecular formula C7H7Cl2NO and a molecular weight of 192.04 g/mol. Its IUPAC name is (2,4-dichloro-6-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(2,4-dichloro-6-methyl-3-pyridinyl)methanol
PubChem CID9267100
Molecular FormulaC7H7Cl2NO
Molecular Weight192.04 g/mol
Exact Mass190.99
IUPAC Name(2,4-dichloro-6-methyl-3-pyridinyl)methanol
SMILESCc1cc(Cl)c(CO)c(Cl)n1
InChIInChI=1S/C7H7Cl2NO/c1-4-2-6(8)5(3-11)7(9)10-4/h2,11H,3H2,1H3
InChIKeyYYRIQTLBJWWQMZ-UHFFFAOYSA-N
XLogP2.19
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.04
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,4-dichloro-6-methyl-3-pyridinyl)methanol?
The IUPAC name of (2,4-dichloro-6-methyl-3-pyridinyl)methanol (CID 9267100) is (2,4-dichloro-6-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (2,4-dichloro-6-methyl-3-pyridinyl)methanol?
The canonical SMILES for (2,4-dichloro-6-methyl-3-pyridinyl)methanol is Cc1cc(Cl)c(CO)c(Cl)n1.
What is the InChIKey of (2,4-dichloro-6-methyl-3-pyridinyl)methanol?
The InChIKey is YYRIQTLBJWWQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl2NO/c1-4-2-6(8)5(3-11)7(9)10-4/h2,11H,3H2,1H3.
What are the key properties of (2,4-dichloro-6-methyl-3-pyridinyl)methanol?
(2,4-dichloro-6-methyl-3-pyridinyl)methanol has a molecular weight of 192.04 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichloro-6-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 9267100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).