N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide

C11H15ClN2O3 — CID 66171426

IUPACN-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
SMILESO=C(CNCC(O)CO)Nc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O3/c12-8-2-1-3-9(4-8)14-11(17)6-13-5-10(16)7-15/h1-4,10,13,15-16H,5-7H2,(H,14,17)
InChIKeyQUJJRPQDQJKTIM-UHFFFAOYSA-N
MW258.70 g/mol
LogP0.22
Rot. Bonds6

About N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide

N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide (PubChem CID 66171426) has the molecular formula C11H15ClN2O3 and a molecular weight of 258.70 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
PubChem CID66171426
Molecular FormulaC11H15ClN2O3
Molecular Weight258.70 g/mol
Exact Mass258.08
IUPAC NameN-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
SMILESO=C(CNCC(O)CO)Nc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O3/c12-8-2-1-3-9(4-8)14-11(17)6-13-5-10(16)7-15/h1-4,10,13,15-16H,5-7H2,(H,14,17)
InChIKeyQUJJRPQDQJKTIM-UHFFFAOYSA-N
XLogP0.22
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.70
LogP ≤ 50.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chlorophenyl)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]acetamide
CID 63298595
N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
CID 103820250
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
CID 115745385
2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
CID 54809235
N-(2,6-difluorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
CID 66170795
N-(3-chlorophenyl)-2-(octylamino)acetamide
CID 78914396
N-(3-chlorophenyl)-2-(2-methoxyethylamino)acetamide
CID 28565603
N-(3-chlorophenyl)-2-(hexadecylamino)acetamide
CID 54809142
N-[3-[[2-(3-chloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54809062
N,N'-bis(3-chlorophenyl)pentanediamide
CID 1011389
N-[4-[[2-(3-chloroanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835550

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide (CID 66171426) is N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide is O=C(CNCC(O)CO)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide?
The InChIKey is QUJJRPQDQJKTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3/c12-8-2-1-3-9(4-8)14-11(17)6-13-5-10(16)7-15/h1-4,10,13,15-16H,5-7H2,(H,14,17).
What are the key properties of N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide?
N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide has a molecular weight of 258.70 g/mol, XLogP of 0.22, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide is sourced from PubChem (CID 66171426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).