5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine

C12H17ClN2O2 — CID 62884966

IUPAC5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine
SMILESCNc1ccc(Cl)c(COCC2CCOC2)n1
InChIInChI=1S/C12H17ClN2O2/c1-14-12-3-2-10(13)11(15-12)8-17-7-9-4-5-16-6-9/h2-3,9H,4-8H2,1H3,(H,14,15)
InChIKeyAHJUETOLEIQYFE-UHFFFAOYSA-N
MW256.73 g/mol
LogP2.33
Rot. Bonds5

About 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine

5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine (PubChem CID 62884966) has the molecular formula C12H17ClN2O2 and a molecular weight of 256.73 g/mol. Its IUPAC name is 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine
PubChem CID62884966
Molecular FormulaC12H17ClN2O2
Molecular Weight256.73 g/mol
Exact Mass256.10
IUPAC Name5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine
SMILESCNc1ccc(Cl)c(COCC2CCOC2)n1
InChIInChI=1S/C12H17ClN2O2/c1-14-12-3-2-10(13)11(15-12)8-17-7-9-4-5-16-6-9/h2-3,9H,4-8H2,1H3,(H,14,15)
InChIKeyAHJUETOLEIQYFE-UHFFFAOYSA-N
XLogP2.33
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,6-dichloro-2-(oxolan-3-ylmethoxymethyl)pyridine
CID 62885453
3,6-dichloro-2-(oxan-4-ylmethoxymethyl)pyridine
CID 62885970
[5-chloro-6-(cyclopentylmethoxymethyl)-2-pyridinyl]hydrazine
CID 66322056
6-(2-butoxyethoxymethyl)-5-chloro-N-methylpyridin-2-amine
CID 55127649
5-chloro-6-(methoxymethyl)-N-methylpyridin-2-amine
CID 62886675
5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine
CID 62886167
N-methyl-1-[4-(oxolan-3-ylmethoxymethyl)phenyl]methanamine
CID 62484188
N-[[3-chloro-6-(oxolan-3-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62321214
6-methyl-2-(oxolan-3-ylmethoxymethyl)-N-propylpyrimidin-4-amine
CID 80653914
5-chloro-6-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
CID 62891652
2-chloro-5-(oxolan-3-ylmethoxymethyl)-1,3,4-thiadiazole
CID 80607681
5-chloro-6-[(4-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
CID 62885465

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine (CID 62884966) is 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine is CNc1ccc(Cl)c(COCC2CCOC2)n1.
What is the InChIKey of 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine?
The InChIKey is AHJUETOLEIQYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O2/c1-14-12-3-2-10(13)11(15-12)8-17-7-9-4-5-16-6-9/h2-3,9H,4-8H2,1H3,(H,14,15).
What are the key properties of 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine?
5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine has a molecular weight of 256.73 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine is sourced from PubChem (CID 62884966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).