3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide

C11H14Cl2N2O — CID 28795530

IUPAC3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide
SMILESCCN(C(=O)CCN)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O/c1-2-15(10(16)6-7-14)11-8(12)4-3-5-9(11)13/h3-5H,2,6-7,14H2,1H3
InChIKeyJIVNAWVUHYVGJR-UHFFFAOYSA-N
MW261.15 g/mol
LogP2.70
Rot. Bonds4

About 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide

3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide (PubChem CID 28795530) has the molecular formula C11H14Cl2N2O and a molecular weight of 261.15 g/mol. Its IUPAC name is 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide
PubChem CID28795530
Molecular FormulaC11H14Cl2N2O
Molecular Weight261.15 g/mol
Exact Mass260.05
IUPAC Name3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide
SMILESCCN(C(=O)CCN)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2N2O/c1-2-15(10(16)6-7-14)11-8(12)4-3-5-9(11)13/h3-5H,2,6-7,14H2,1H3
InChIKeyJIVNAWVUHYVGJR-UHFFFAOYSA-N
XLogP2.70
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.15
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide
CID 28795326
3-amino-N-(3-chloro-2-methylphenyl)-N-ethylpropanamide
CID 28795362
3-(N-butanoyl-2,6-dichloroanilino)propanoic acid
CID 82320751
3-amino-N-[(2-chlorophenyl)methyl]-N-ethylpropanamide
CID 60938834
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
3-amino-N-(4-bromophenyl)-N-ethylpropanamide
CID 28795394
3-amino-N-(5-chloro-2-methoxyphenyl)-N-ethylpropanamide
CID 28795390
2-chloro-N-(2,6-diethylphenyl)-N-ethylacetamide
CID 163807844
ethyl 2-(2,6-dichloro-N-(2-ethoxy-2-oxoethyl)anilino)acetate
CID 171623851
2-amino-N-[(2,3-dichlorophenyl)methyl]-N-ethylacetamide
CID 66568409
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
3-amino-N-[(4-chlorophenyl)methyl]-N-ethylpropanamide
CID 92931902

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide?
The IUPAC name of 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide (CID 28795530) is 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide.
What is the SMILES notation for 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide?
The canonical SMILES for 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide is CCN(C(=O)CCN)c1c(Cl)cccc1Cl.
What is the InChIKey of 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide?
The InChIKey is JIVNAWVUHYVGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O/c1-2-15(10(16)6-7-14)11-8(12)4-3-5-9(11)13/h3-5H,2,6-7,14H2,1H3.
What are the key properties of 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide?
3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide has a molecular weight of 261.15 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,6-dichlorophenyl)-N-ethylpropanamide is sourced from PubChem (CID 28795530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).