6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine

C15H18ClN3 — CID 79243754

IUPAC6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)Cc2ccc(Cl)cc2)n1
InChIInChI=1S/C15H18ClN3/c1-17-15-5-3-4-14(18-15)11-19(2)10-12-6-8-13(16)9-7-12/h3-9H,10-11H2,1-2H3,(H,17,18)
InChIKeySDGBTYGLCVDSON-UHFFFAOYSA-N
MW275.78 g/mol
LogP3.41
Rot. Bonds5

About 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine

6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine (PubChem CID 79243754) has the molecular formula C15H18ClN3 and a molecular weight of 275.78 g/mol. Its IUPAC name is 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
PubChem CID79243754
Molecular FormulaC15H18ClN3
Molecular Weight275.78 g/mol
Exact Mass275.12
IUPAC Name6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)Cc2ccc(Cl)cc2)n1
InChIInChI=1S/C15H18ClN3/c1-17-15-5-3-4-14(18-15)11-19(2)10-12-6-8-13(16)9-7-12/h3-9H,10-11H2,1-2H3,(H,17,18)
InChIKeySDGBTYGLCVDSON-UHFFFAOYSA-N
XLogP3.41
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243670
6-[(4-chlorophenyl)methylsulfanylmethyl]-N-methylpyridin-2-amine
CID 114791858
6-[[1-(4-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79233617
1-(4-fluorophenyl)-N-[(6-hydrazinyl-2-pyridinyl)methyl]-N-methylmethanamine
CID 79243570
6-[[(5-bromothiophen-3-yl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79244017
6-[(4-chlorophenyl)sulfanylmethyl]-N-methylpyridin-2-amine
CID 79239984
1-[6-[[(3-chlorophenyl)methyl-methylamino]methyl]-2-pyridinyl]-N-methylmethanamine
CID 106906091
N-methyl-6-[[methyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 79243333
6-(chloromethyl)-N-methylpyridin-2-amine
CID 90018350
6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 79243204
N-methyl-6-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]pyridin-2-amine
CID 79231213
N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine
CID 137379420

Frequently Asked Questions

What is the IUPAC name of 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine (CID 79243754) is 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine is CNc1cccc(CN(C)Cc2ccc(Cl)cc2)n1.
What is the InChIKey of 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine?
The InChIKey is SDGBTYGLCVDSON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3/c1-17-15-5-3-4-14(18-15)11-19(2)10-12-6-8-13(16)9-7-12/h3-9H,10-11H2,1-2H3,(H,17,18).
What are the key properties of 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine?
6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine has a molecular weight of 275.78 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79243754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).