2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide

C13H19ClN2O3 — CID 139902291

IUPAC2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide
SMILESCOCCN(CCOC)c1ccc(Cl)cc1C(N)=O
InChIInChI=1S/C13H19ClN2O3/c1-18-7-5-16(6-8-19-2)12-4-3-10(14)9-11(12)13(15)17/h3-4,9H,5-8H2,1-2H3,(H2,15,17)
InChIKeySLRYZBRIEYJDTP-UHFFFAOYSA-N
MW286.76 g/mol
LogP1.54
Rot. Bonds8

About 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide

2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide (PubChem CID 139902291) has the molecular formula C13H19ClN2O3 and a molecular weight of 286.76 g/mol. Its IUPAC name is 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide.

Molecular Properties

Compound Name2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide
PubChem CID139902291
Molecular FormulaC13H19ClN2O3
Molecular Weight286.76 g/mol
Exact Mass286.11
IUPAC Name2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide
SMILESCOCCN(CCOC)c1ccc(Cl)cc1C(N)=O
InChIInChI=1S/C13H19ClN2O3/c1-18-7-5-16(6-8-19-2)12-4-3-10(14)9-11(12)13(15)17/h3-4,9H,5-8H2,1-2H3,(H2,15,17)
InChIKeySLRYZBRIEYJDTP-UHFFFAOYSA-N
XLogP1.54
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-[2-cyanoethyl(2-methoxyethyl)amino]benzamide
CID 55221201
2-(aminomethyl)-4-chloro-N,N-bis(2-methoxyethyl)aniline
CID 62493985
4-amino-2-[2-hydroxyethyl(2-methoxyethyl)amino]benzamide
CID 113467671
2-[bis(2-methoxyethyl)amino]-5-methylbenzoic acid
CID 54593533
2-[2-carbamoyl-N-(2-methoxyethyl)anilino]acetic acid
CID 54969050
5-chloro-2-(chloromethyl)-N,N-bis(2-methoxyethyl)aniline
CID 114846465
5-chloro-2-[cyclopropyl(2-methoxyethyl)amino]benzoic acid
CID 55139261
5-chloro-2-[3-methoxypropyl(methyl)amino]benzoic acid
CID 63007718
methyl 3-[4-bromo-2-carbamothioyl-N-(2-methoxyethyl)anilino]propanoate
CID 114891984
1-(2,5-dichlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanone
CID 61427107
4-chloro-N'-hydroxy-2-[2-methoxyethyl(methyl)amino]benzenecarboximidamide
CID 76985005
5-amino-2-[2-methoxyethyl(propan-2-yl)amino]benzamide
CID 82960995

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide?
The IUPAC name of 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide (CID 139902291) is 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide.
What is the SMILES notation for 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide?
The canonical SMILES for 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide is COCCN(CCOC)c1ccc(Cl)cc1C(N)=O.
What is the InChIKey of 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide?
The InChIKey is SLRYZBRIEYJDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O3/c1-18-7-5-16(6-8-19-2)12-4-3-10(14)9-11(12)13(15)17/h3-4,9H,5-8H2,1-2H3,(H2,15,17).
What are the key properties of 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide?
2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide has a molecular weight of 286.76 g/mol, XLogP of 1.54, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methoxyethyl)amino]-5-chlorobenzamide is sourced from PubChem (CID 139902291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).