N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide

C16H17ClN2O2 — CID 43389783

IUPACN-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
SMILESO=C(CNCC(O)c1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(21)11-18-10-15(20)12-4-2-1-3-5-12/h1-9,15,18,20H,10-11H2,(H,19,21)
InChIKeyGJUPNEQNNSTGEI-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.60
Rot. Bonds6

About N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide

N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide (PubChem CID 43389783) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
PubChem CID43389783
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
SMILESO=C(CNCC(O)c1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(21)11-18-10-15(20)12-4-2-1-3-5-12/h1-9,15,18,20H,10-11H2,(H,19,21)
InChIKeyGJUPNEQNNSTGEI-UHFFFAOYSA-N
XLogP2.60
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide (CID 43389783) is N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide is O=C(CNCC(O)c1ccccc1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The InChIKey is GJUPNEQNNSTGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(21)11-18-10-15(20)12-4-2-1-3-5-12/h1-9,15,18,20H,10-11H2,(H,19,21).
What are the key properties of N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide has a molecular weight of 304.78 g/mol, XLogP of 2.60, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide is sourced from PubChem (CID 43389783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).