N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide

C11H14Cl2N2O2 — CID 82358493

IUPACN-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide
SMILESCC(NCCO)C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H14Cl2N2O2/c1-7(14-4-5-16)11(17)15-10-6-8(12)2-3-9(10)13/h2-3,6-7,14,16H,4-5H2,1H3,(H,15,17)
InChIKeyKKAHQHBLZFNOBO-UHFFFAOYSA-N
MW277.15 g/mol
LogP1.90
Rot. Bonds5

About N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide

N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide (PubChem CID 82358493) has the molecular formula C11H14Cl2N2O2 and a molecular weight of 277.15 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide
PubChem CID82358493
Molecular FormulaC11H14Cl2N2O2
Molecular Weight277.15 g/mol
Exact Mass276.04
IUPAC NameN-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide
SMILESCC(NCCO)C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H14Cl2N2O2/c1-7(14-4-5-16)11(17)15-10-6-8(12)2-3-9(10)13/h2-3,6-7,14,16H,4-5H2,1H3,(H,15,17)
InChIKeyKKAHQHBLZFNOBO-UHFFFAOYSA-N
XLogP1.90
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.15
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-bromo-N-(2,5-dichlorophenyl)propanamide
CID 94831435
N-(3-chloro-4-methylphenyl)-2-(2-hydroxyethylamino)propanamide
CID 82358486
1-(2,5-dichlorophenyl)-3-[(2S)-1-hydroxypropan-2-yl]urea
CID 79023669
N-[4-[[1-(2,5-dichloroanilino)-1-oxopropan-2-yl]amino]phenyl]-2-methylpropanamide
CID 55351392
1-(2,5-dichlorophenyl)-3-(3-oxobutan-2-yl)urea
CID 64994195
N-(2,5-dichlorophenyl)-2-(2-methylpropylsulfanyl)propanamide
CID 55315484
2-chloro-N-(2,5-dichlorophenyl)-3-oxobutanamide
CID 142639963
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-methylpropanamide
CID 47097183
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
1-(2,5-dichlorophenyl)-3-(1,3-dihydroxypropan-2-yl)urea
CID 65313053
2-chloro-N-[(2,5-dichlorophenyl)carbamoyl]propanamide
CID 43145990
1-(2,5-dichlorophenyl)-3-(3-methyl-2-oxobutyl)urea
CID 64993936

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide (CID 82358493) is N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide is CC(NCCO)C(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide?
The InChIKey is KKAHQHBLZFNOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O2/c1-7(14-4-5-16)11(17)15-10-6-8(12)2-3-9(10)13/h2-3,6-7,14,16H,4-5H2,1H3,(H,15,17).
What are the key properties of N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide?
N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide has a molecular weight of 277.15 g/mol, XLogP of 1.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(2-hydroxyethylamino)propanamide is sourced from PubChem (CID 82358493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).