2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine

C12H17Cl2NO — CID 167249778

IUPAC2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine
SMILESCOCCN(C)CCc1cccc(Cl)c1Cl
InChIInChI=1S/C12H17Cl2NO/c1-15(8-9-16-2)7-6-10-4-3-5-11(13)12(10)14/h3-5H,6-9H2,1-2H3
InChIKeyMMVVXEMLQGSIAF-UHFFFAOYSA-N
MW262.18 g/mol
LogP3.11
Rot. Bonds6

About 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine

2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine (PubChem CID 167249778) has the molecular formula C12H17Cl2NO and a molecular weight of 262.18 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine
PubChem CID167249778
Molecular FormulaC12H17Cl2NO
Molecular Weight262.18 g/mol
Exact Mass261.07
IUPAC Name2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine
SMILESCOCCN(C)CCc1cccc(Cl)c1Cl
InChIInChI=1S/C12H17Cl2NO/c1-15(8-9-16-2)7-6-10-4-3-5-11(13)12(10)14/h3-5H,6-9H2,1-2H3
InChIKeyMMVVXEMLQGSIAF-UHFFFAOYSA-N
XLogP3.11
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.18
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichlorophenyl)-N-ethyl-N-methylethanamine
CID 167249773
2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)ethanamine
CID 62800794
2-chloro-6-[[2-[2-methoxyethyl(methyl)amino]ethylamino]methyl]phenol
CID 112554421
3-chloro-1-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzene-1,2-diamine
CID 104834477
2-chloro-6-(chloromethyl)-N,N-bis(2-methoxyethyl)aniline
CID 114067710
N-[(2,3-dichlorophenyl)methyl]-4-methoxybutan-2-amine
CID 62733353
3-chloro-1-N-(2-methoxyethyl)-1-N-methylbenzene-1,2-diamine
CID 104834240
1,2-dichloro-3-(2-phenoxyethyl)benzene
CID 91220321
2-[(2-chlorophenyl)methyl]-1-ethyl-3-[2-[2-methoxyethyl(methyl)amino]ethyl]guanidine
CID 111175303
1-(2,3-dichlorophenyl)-3-(2-methoxyethylamino)propan-2-one
CID 107311411
2-chloro-6-[[2-methoxyethyl(propan-2-yl)amino]methyl]phenol
CID 112616395
N-ethyl-2-[2-[[2-methoxyethyl(methyl)amino]methyl]phenyl]ethanamine
CID 115464004

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine?
The IUPAC name of 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine (CID 167249778) is 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine is COCCN(C)CCc1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine?
The InChIKey is MMVVXEMLQGSIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Cl2NO/c1-15(8-9-16-2)7-6-10-4-3-5-11(13)12(10)14/h3-5H,6-9H2,1-2H3.
What are the key properties of 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine?
2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine has a molecular weight of 262.18 g/mol, XLogP of 3.11, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-N-(2-methoxyethyl)-N-methylethanamine is sourced from PubChem (CID 167249778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).