5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine

C11H17ClN2O — CID 62886167

IUPAC5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine
SMILESCNc1ccc(Cl)c(COCC(C)C)n1
InChIInChI=1S/C11H17ClN2O/c1-8(2)6-15-7-10-9(12)4-5-11(13-3)14-10/h4-5,8H,6-7H2,1-3H3,(H,13,14)
InChIKeyRXBCWQRAKIOUEY-UHFFFAOYSA-N
MW228.72 g/mol
LogP2.95
Rot. Bonds5

About 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine

5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine (PubChem CID 62886167) has the molecular formula C11H17ClN2O and a molecular weight of 228.72 g/mol. Its IUPAC name is 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine
PubChem CID62886167
Molecular FormulaC11H17ClN2O
Molecular Weight228.72 g/mol
Exact Mass228.10
IUPAC Name5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine
SMILESCNc1ccc(Cl)c(COCC(C)C)n1
InChIInChI=1S/C11H17ClN2O/c1-8(2)6-15-7-10-9(12)4-5-11(13-3)14-10/h4-5,8H,6-7H2,1-3H3,(H,13,14)
InChIKeyRXBCWQRAKIOUEY-UHFFFAOYSA-N
XLogP2.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.72
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-ethyl-6-[2-(2-methylpropoxy)ethoxymethyl]pyridin-2-amine
CID 106449250
5-chloro-6-(methoxymethyl)-N-methylpyridin-2-amine
CID 62886675
6-(2-butoxyethoxymethyl)-5-chloro-N-methylpyridin-2-amine
CID 55127649
5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine
CID 82005693
5-chloro-N-ethyl-6-(4-methylpentoxymethyl)pyridin-2-amine
CID 62885644
5-chloro-6-[(4-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
CID 62885465
5-chloro-N-methyl-6-[(2,4,6-trichlorophenoxy)methyl]pyridin-2-amine
CID 63487402
5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine
CID 62884966
5-chloro-N-methyl-6-[(2-methylcyclohexyl)oxymethyl]pyridin-2-amine
CID 62885468
5-chloro-6-[(4-chloro-3-ethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 63486730
5-chloro-N-methyl-6-[[methyl(3-methylbutan-2-yl)amino]methyl]pyridin-2-amine
CID 62891142
6-[[butan-2-yl(2-methoxyethyl)amino]methyl]-5-chloro-N-methylpyridin-2-amine
CID 55127400

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine (CID 62886167) is 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine is CNc1ccc(Cl)c(COCC(C)C)n1.
What is the InChIKey of 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine?
The InChIKey is RXBCWQRAKIOUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O/c1-8(2)6-15-7-10-9(12)4-5-11(13-3)14-10/h4-5,8H,6-7H2,1-3H3,(H,13,14).
What are the key properties of 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine?
5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine has a molecular weight of 228.72 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine is sourced from PubChem (CID 62886167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).