2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride

C12H17Cl3N2O2 — CID 120833103

IUPAC2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
SMILESCNC(C)CNC(=O)COc1c(Cl)cccc1Cl.Cl
InChIInChI=1S/C12H16Cl2N2O2.ClH/c1-8(15-2)6-16-11(17)7-18-12-9(13)4-3-5-10(12)14;/h3-5,8,15H,6-7H2,1-2H3,(H,16,17);1H
InChIKeyCZPXUGGMNZMEFM-UHFFFAOYSA-N
MW327.64 g/mol
LogP2.52
Rot. Bonds6

About 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride

2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride (PubChem CID 120833103) has the molecular formula C12H17Cl3N2O2 and a molecular weight of 327.64 g/mol. Its IUPAC name is 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
PubChem CID120833103
Molecular FormulaC12H17Cl3N2O2
Molecular Weight327.64 g/mol
Exact Mass326.04
IUPAC Name2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
SMILESCNC(C)CNC(=O)COc1c(Cl)cccc1Cl.Cl
InChIInChI=1S/C12H16Cl2N2O2.ClH/c1-8(15-2)6-16-11(17)7-18-12-9(13)4-3-5-10(12)14;/h3-5,8,15H,6-7H2,1-2H3,(H,16,17);1H
InChIKeyCZPXUGGMNZMEFM-UHFFFAOYSA-N
XLogP2.52
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.64
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(methylamino)propyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 120828955
N-[2-(methylamino)propyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 120830158
N-[2-(methylamino)propyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 120828911
2-(3-chloro-4-fluorophenoxy)-N-[2-(methylamino)propyl]acetamide
CID 120831240
2-(3-acetylphenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120828020
2-(4-bromophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120829879
2-chloro-6-methoxy-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120830304
N-[2-(methylamino)propyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride
CID 120831954
4-[2-[2-(methylamino)propylamino]-2-oxoethoxy]benzamide
CID 120826819
N-(2-cyanoethyl)-2-(2,6-dichlorophenoxy)acetamide
CID 46568862
N-[2-(methylamino)propyl]-2-(4-propanoylphenoxy)acetamide
CID 120828053
2-[2-chloro-6-[(2-methylpropylamino)methyl]phenoxy]-N-methylacetamide
CID 112610545

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride?
The IUPAC name of 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride (CID 120833103) is 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride?
The canonical SMILES for 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride is CNC(C)CNC(=O)COc1c(Cl)cccc1Cl.Cl.
What is the InChIKey of 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride?
The InChIKey is CZPXUGGMNZMEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O2.ClH/c1-8(15-2)6-16-11(17)7-18-12-9(13)4-3-5-10(12)14;/h3-5,8,15H,6-7H2,1-2H3,(H,16,17);1H.
What are the key properties of 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride?
2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride has a molecular weight of 327.64 g/mol, XLogP of 2.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride is sourced from PubChem (CID 120833103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).