N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine

C10H13Cl2N — CID 60516634

IUPACN-[(2,6-dichlorophenyl)methyl]-N-methylethanamine
SMILESCCN(C)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C10H13Cl2N/c1-3-13(2)7-8-9(11)5-4-6-10(8)12/h4-6H,3,7H2,1-2H3
InChIKeyBIMPULKDEOZFGL-UHFFFAOYSA-N
MW218.13 g/mol
LogP3.45
Rot. Bonds3

About N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine

N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine (PubChem CID 60516634) has the molecular formula C10H13Cl2N and a molecular weight of 218.13 g/mol. Its IUPAC name is N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine.

Molecular Properties

Compound NameN-[(2,6-dichlorophenyl)methyl]-N-methylethanamine
PubChem CID60516634
Molecular FormulaC10H13Cl2N
Molecular Weight218.13 g/mol
Exact Mass217.04
IUPAC NameN-[(2,6-dichlorophenyl)methyl]-N-methylethanamine
SMILESCCN(C)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C10H13Cl2N/c1-3-13(2)7-8-9(11)5-4-6-10(8)12/h4-6H,3,7H2,1-2H3
InChIKeyBIMPULKDEOZFGL-UHFFFAOYSA-N
XLogP3.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.13
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-N-[(2,6-dichlorophenyl)methyl]-N-methylpropan-1-amine
CID 63388129
N'-[(2,6-dichlorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
CID 43374397
N'-[(2,6-dichlorophenyl)methyl]-N',2,2-trimethylpropane-1,3-diamine
CID 79645596
3-[(2,6-dichlorophenyl)methyl-methylamino]-2-methylpropanoic acid
CID 55007398
2-chloro-3-[[ethyl(methyl)amino]methyl]phenol
CID 127011573
N-[(2-bromo-6-chlorophenyl)methyl]-N-ethylethanamine
CID 125116042
N-[(2,6-dichlorophenyl)methyl]-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 22196071
N-[(2,6-dichlorophenyl)methyl]-N-ethylazetidin-3-amine
CID 66182519
2-[(2-chloro-6-hydroxyphenyl)methyl-methylamino]-N,N-dimethylacetamide
CID 82977349
3-[(2-chloro-6-hydroxyphenyl)methyl-methylamino]propanoic acid
CID 114322202
2-(2,3-dichlorophenyl)-N-ethyl-N-methylethanamine
CID 167249773
3-chloro-2-[[2-ethoxyethyl(methyl)amino]methyl]aniline
CID 81053515

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine?
The IUPAC name of N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine (CID 60516634) is N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine.
What is the SMILES notation for N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine?
The canonical SMILES for N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine is CCN(C)Cc1c(Cl)cccc1Cl.
What is the InChIKey of N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine?
The InChIKey is BIMPULKDEOZFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N/c1-3-13(2)7-8-9(11)5-4-6-10(8)12/h4-6H,3,7H2,1-2H3.
What are the key properties of N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine?
N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine has a molecular weight of 218.13 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dichlorophenyl)methyl]-N-methylethanamine is sourced from PubChem (CID 60516634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).