N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine

C14H23N3O — CID 55228186

IUPACN-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine
SMILESCNCc1cccc(N(C)CC2CCOCC2)n1
InChIInChI=1S/C14H23N3O/c1-15-10-13-4-3-5-14(16-13)17(2)11-12-6-8-18-9-7-12/h3-5,12,15H,6-11H2,1-2H3
InChIKeyJTXNJYHGSYKRJS-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.66
Rot. Bonds5

About N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine

N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine (PubChem CID 55228186) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine
PubChem CID55228186
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine
SMILESCNCc1cccc(N(C)CC2CCOCC2)n1
InChIInChI=1S/C14H23N3O/c1-15-10-13-4-3-5-14(16-13)17(2)11-12-6-8-18-9-7-12/h3-5,12,15H,6-11H2,1-2H3
InChIKeyJTXNJYHGSYKRJS-UHFFFAOYSA-N
XLogP1.66
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine?
The IUPAC name of N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine (CID 55228186) is N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine is CNCc1cccc(N(C)CC2CCOCC2)n1.
What is the InChIKey of N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine?
The InChIKey is JTXNJYHGSYKRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-15-10-13-4-3-5-14(16-13)17(2)11-12-6-8-18-9-7-12/h3-5,12,15H,6-11H2,1-2H3.
What are the key properties of N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine?
N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine has a molecular weight of 249.36 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(methylaminomethyl)-N-(oxan-4-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 55228186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).