5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine

C15H19ClN4 — CID 62279474

IUPAC5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESCNCc1nc(N(C)CCc2ccccn2)ccc1Cl
InChIInChI=1S/C15H19ClN4/c1-17-11-14-13(16)6-7-15(19-14)20(2)10-8-12-5-3-4-9-18-12/h3-7,9,17H,8,10-11H2,1-2H3
InChIKeyGSDALGLDHADRNL-UHFFFAOYSA-N
MW290.80 g/mol
LogP2.53
Rot. Bonds6

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

5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine (PubChem CID 62279474) has the molecular formula C15H19ClN4 and a molecular weight of 290.80 g/mol. Its IUPAC name is 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
PubChem CID62279474
Molecular FormulaC15H19ClN4
Molecular Weight290.80 g/mol
Exact Mass290.13
IUPAC Name5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESCNCc1nc(N(C)CCc2ccccn2)ccc1Cl
InChIInChI=1S/C15H19ClN4/c1-17-11-14-13(16)6-7-15(19-14)20(2)10-8-12-5-3-4-9-18-12/h3-7,9,17H,8,10-11H2,1-2H3
InChIKeyGSDALGLDHADRNL-UHFFFAOYSA-N
XLogP2.53
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.80
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine (CID 62279474) is 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine is CNCc1nc(N(C)CCc2ccccn2)ccc1Cl.
What is the InChIKey of 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The InChIKey is GSDALGLDHADRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4/c1-17-11-14-13(16)6-7-15(19-14)20(2)10-8-12-5-3-4-9-18-12/h3-7,9,17H,8,10-11H2,1-2H3.
What are the key properties of 5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine has a molecular weight of 290.80 g/mol, XLogP of 2.53, 6 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-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine is sourced from PubChem (CID 62279474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).