3-chloro-N-(2-hydroxyethyl)benzamide

C9H10ClNO2 — CID 2181761

IUPAC3-chloro-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1cccc(Cl)c1
InChIInChI=1S/C9H10ClNO2/c10-8-3-1-2-7(6-8)9(13)11-4-5-12/h1-3,6,12H,4-5H2,(H,11,13)
InChIKeyWGQQLFYOIGBNNF-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.06
Rot. Bonds3

About 3-chloro-N-(2-hydroxyethyl)benzamide

3-chloro-N-(2-hydroxyethyl)benzamide (PubChem CID 2181761) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 3-chloro-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(2-hydroxyethyl)benzamide
PubChem CID2181761
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name3-chloro-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1cccc(Cl)c1
InChIInChI=1S/C9H10ClNO2/c10-8-3-1-2-7(6-8)9(13)11-4-5-12/h1-3,6,12H,4-5H2,(H,11,13)
InChIKeyWGQQLFYOIGBNNF-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-chlorobenzoyl)amino]ethyl-dimethylazanium chloride
CID 18531817
3-chloro-N-[2-[(4-propan-2-ylbenzoyl)amino]ethyl]benzamide
CID 108571437
3-[(3-chlorophenyl)-methylsulfamoyl]-N-(2-hydroxyethyl)benzamide
CID 78783671
N-[(Z)-3-aminopent-3-enyl]-3-chlorobenzamide
CID 118524324
tert-butyl N-[4-[(3-chlorobenzoyl)amino]butyl]carbamate
CID 139824741
3-chloro-N-(2-thiophen-2-ylethyl)benzamide
CID 18111212
3-chloro-N-(2-piperidin-1-ylethyl)benzamide
CID 4581034
methyl 6-[(3-chlorobenzoyl)amino]hexanoate
CID 43404554
methyl 2-[(3-chlorobenzoyl)amino]acetate
CID 669189
N-[2-[(3-chlorobenzoyl)amino]ethyl]-2,4-difluorobenzamide
CID 108571424
prop-2-enyl N-[2-[(3-chlorobenzoyl)amino]ethyl]carbamate
CID 108571431
3,5-dichloro-N-[4-(2-hydroxyethylcarbamoyl)phenyl]benzamide
CID 78862424

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 3-chloro-N-(2-hydroxyethyl)benzamide (CID 2181761) is 3-chloro-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 3-chloro-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 3-chloro-N-(2-hydroxyethyl)benzamide is O=C(NCCO)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2-hydroxyethyl)benzamide?
The InChIKey is WGQQLFYOIGBNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c10-8-3-1-2-7(6-8)9(13)11-4-5-12/h1-3,6,12H,4-5H2,(H,11,13).
What are the key properties of 3-chloro-N-(2-hydroxyethyl)benzamide?
3-chloro-N-(2-hydroxyethyl)benzamide has a molecular weight of 199.64 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 2181761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).