5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine

C16H20ClN3O — CID 62294612

IUPAC5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1nc(N(C)Cc2ccc(OC)cc2)ccc1Cl
InChIInChI=1S/C16H20ClN3O/c1-18-10-15-14(17)8-9-16(19-15)20(2)11-12-4-6-13(21-3)7-5-12/h4-9,18H,10-11H2,1-3H3
InChIKeyJVRPFESASPBMDR-UHFFFAOYSA-N
MW305.81 g/mol
LogP3.10
Rot. Bonds6

About 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine

5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine (PubChem CID 62294612) has the molecular formula C16H20ClN3O and a molecular weight of 305.81 g/mol. Its IUPAC name is 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
PubChem CID62294612
Molecular FormulaC16H20ClN3O
Molecular Weight305.81 g/mol
Exact Mass305.13
IUPAC Name5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1nc(N(C)Cc2ccc(OC)cc2)ccc1Cl
InChIInChI=1S/C16H20ClN3O/c1-18-10-15-14(17)8-9-16(19-15)20(2)11-12-4-6-13(21-3)7-5-12/h4-9,18H,10-11H2,1-3H3
InChIKeyJVRPFESASPBMDR-UHFFFAOYSA-N
XLogP3.10
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.81
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-(3-methoxypropyl)-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 63008843
N'-[5-chloro-6-(methylaminomethyl)-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699861
N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 62285649
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62294613
4-N-[(4-methoxyphenyl)methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 80794760
[3-chloro-6-[methyl(pyridin-4-ylmethyl)amino]-2-pyridinyl]methanol
CID 61255835
6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine
CID 62286054
N-[(4-methoxyphenyl)methyl]-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 165435434
5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 62279474
N-[(4-methoxyphenyl)methyl]-N-methyl-3-(methylaminomethyl)pyridin-2-amine
CID 62294438
6-N-[(4-methoxyphenyl)methyl]-6-N-methyl-3-methylsulfonylpyridine-2,6-diamine
CID 171483434
5-chloro-6-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 62891685

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine (CID 62294612) is 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine is CNCc1nc(N(C)Cc2ccc(OC)cc2)ccc1Cl.
What is the InChIKey of 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The InChIKey is JVRPFESASPBMDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O/c1-18-10-15-14(17)8-9-16(19-15)20(2)11-12-4-6-13(21-3)7-5-12/h4-9,18H,10-11H2,1-3H3.
What are the key properties of 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine has a molecular weight of 305.81 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 62294612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).