2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide

C16H25ClN2O3 — CID 78807153

IUPAC2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide
SMILESCOCCN(CCOC)CC(=O)NC(C)c1ccccc1Cl
InChIInChI=1S/C16H25ClN2O3/c1-13(14-6-4-5-7-15(14)17)18-16(20)12-19(8-10-21-2)9-11-22-3/h4-7,13H,8-12H2,1-3H3,(H,18,20)
InChIKeyIODRCFPFDJCGGK-UHFFFAOYSA-N
MW328.84 g/mol
LogP2.11
Rot. Bonds10

About 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide

2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide (PubChem CID 78807153) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide
PubChem CID78807153
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC Name2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide
SMILESCOCCN(CCOC)CC(=O)NC(C)c1ccccc1Cl
InChIInChI=1S/C16H25ClN2O3/c1-13(14-6-4-5-7-15(14)17)18-16(20)12-19(8-10-21-2)9-11-22-3/h4-7,13H,8-12H2,1-3H3,(H,18,20)
InChIKeyIODRCFPFDJCGGK-UHFFFAOYSA-N
XLogP2.11
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-chlorophenyl)ethyl]-3-methylbutanamide
CID 78773468
2-[[2-(dimethylamino)-2-oxoethyl]-(2-methoxyethyl)amino]-N-(1-naphthalen-1-ylethyl)acetamide
CID 60503782
N-[1-(2-chlorophenyl)ethyl]-2-(methylamino)acetamide
CID 60641198
2-amino-N-[(1S)-1-(2-chlorophenyl)ethyl]acetamide
CID 81378449
2-[bis(2-methoxyethyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 33483708
2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride
CID 119268984
N-(2-chlorophenyl)-2-[[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-methylamino]acetamide
CID 9037030
2-[[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 84869554
N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide
CID 41176984
N-[(1S)-1-(2-chlorophenyl)ethyl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 39973443
2-[[2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772390
N-[(1S)-1-(2-chlorophenyl)ethyl]-4-hydroxybutanamide
CID 81378925

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide?
The IUPAC name of 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide (CID 78807153) is 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide?
The canonical SMILES for 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide is COCCN(CCOC)CC(=O)NC(C)c1ccccc1Cl.
What is the InChIKey of 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide?
The InChIKey is IODRCFPFDJCGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O3/c1-13(14-6-4-5-7-15(14)17)18-16(20)12-19(8-10-21-2)9-11-22-3/h4-7,13H,8-12H2,1-3H3,(H,18,20).
What are the key properties of 2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide?
2-[bis(2-methoxyethyl)amino]-N-[1-(2-chlorophenyl)ethyl]acetamide has a molecular weight of 328.84 g/mol, XLogP of 2.11, 10 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]-N-[1-(2-chlorophenyl)ethyl]acetamide is sourced from PubChem (CID 78807153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).