6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine

C16H20ClN3 — CID 79234609

IUPAC6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)C(C)c2ccccc2Cl)n1
InChIInChI=1S/C16H20ClN3/c1-12(14-8-4-5-9-15(14)17)20(3)11-13-7-6-10-16(18-2)19-13/h4-10,12H,11H2,1-3H3,(H,18,19)
InChIKeyYXZRDDGDDPKRMU-UHFFFAOYSA-N
MW289.81 g/mol
LogP3.97
Rot. Bonds5

About 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine

6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine (PubChem CID 79234609) has the molecular formula C16H20ClN3 and a molecular weight of 289.81 g/mol. Its IUPAC name is 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
PubChem CID79234609
Molecular FormulaC16H20ClN3
Molecular Weight289.81 g/mol
Exact Mass289.13
IUPAC Name6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)C(C)c2ccccc2Cl)n1
InChIInChI=1S/C16H20ClN3/c1-12(14-8-4-5-9-15(14)17)20(3)11-13-7-6-10-16(18-2)19-13/h4-10,12H,11H2,1-3H3,(H,18,19)
InChIKeyYXZRDDGDDPKRMU-UHFFFAOYSA-N
XLogP3.97
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[1-(4-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79233617
N-methyl-6-[[methyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 79243333
6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243670
N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
CID 79243618
1-(2-chlorophenyl)-N-[(4-chloro-2-pyridinyl)methyl]-N-methylethanamine
CID 79255628
N-[[2-(aminomethyl)phenyl]methyl]-1-(2-chlorophenyl)-N-methylethanamine
CID 62980012
N-[[3-(aminomethyl)-2-fluorophenyl]methyl]-1-(2-chlorophenyl)-N-methylethanamine
CID 107113377
2-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]pyridin-4-amine
CID 79251856
1-(2-chlorophenyl)-N-ethyl-N-methylethanamine
CID 126986399
6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243754
6-(chloromethyl)-N-methylpyridin-2-amine
CID 90018350
N'-[1-(2-chlorophenyl)ethyl]-N,N'-dimethylpropane-1,3-diamine
CID 62985212

Frequently Asked Questions

What is the IUPAC name of 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine (CID 79234609) is 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine is CNc1cccc(CN(C)C(C)c2ccccc2Cl)n1.
What is the InChIKey of 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine?
The InChIKey is YXZRDDGDDPKRMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3/c1-12(14-8-4-5-9-15(14)17)20(3)11-13-7-6-10-16(18-2)19-13/h4-10,12H,11H2,1-3H3,(H,18,19).
What are the key properties of 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine?
6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine has a molecular weight of 289.81 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79234609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).