2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide

C13H17ClN2O3 — CID 60670695

IUPAC2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
SMILESCCN(CCO)C(=O)CNC(=O)c1ccccc1Cl
InChIInChI=1S/C13H17ClN2O3/c1-2-16(7-8-17)12(18)9-15-13(19)10-5-3-4-6-11(10)14/h3-6,17H,2,7-9H2,1H3,(H,15,19)
InChIKeyPIMKXVRZWYSTLC-UHFFFAOYSA-N
MW284.74 g/mol
LogP0.91
Rot. Bonds6

About 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide

2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide (PubChem CID 60670695) has the molecular formula C13H17ClN2O3 and a molecular weight of 284.74 g/mol. Its IUPAC name is 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
PubChem CID60670695
Molecular FormulaC13H17ClN2O3
Molecular Weight284.74 g/mol
Exact Mass284.09
IUPAC Name2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
SMILESCCN(CCO)C(=O)CNC(=O)c1ccccc1Cl
InChIInChI=1S/C13H17ClN2O3/c1-2-16(7-8-17)12(18)9-15-13(19)10-5-3-4-6-11(10)14/h3-6,17H,2,7-9H2,1H3,(H,15,19)
InChIKeyPIMKXVRZWYSTLC-UHFFFAOYSA-N
XLogP0.91
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.74
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]-2-(trifluoromethyl)benzamide
CID 109468293
N-[2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-2-oxoethyl]-2-chlorobenzamide
CID 24546452
ethyl 2-[[2-[(2-chlorobenzoyl)amino]acetyl]-ethylamino]acetate
CID 78901913
2-chloro-N-[2-[ethyl(methyl)amino]-2-oxoethyl]benzamide
CID 134063159
2-fluoro-N-[2-[2-hydroxyethyl(propyl)amino]-2-oxoethyl]benzamide
CID 60656549
N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 60653313
2-chloro-N-[(2S)-1-[ethyl(2-hydroxyethyl)amino]-3-methyl-1-oxobutan-2-yl]benzamide
CID 97191731
3-[[2-[(2-chlorobenzoyl)amino]acetyl]-methylamino]propanoic acid
CID 60988640
2-chloro-N-ethyl-N-(3-hydroxypropyl)benzamide
CID 115771499
2-anilino-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 60945484
N-[2-[2-hydroxyethyl(propyl)amino]-2-oxoethyl]benzamide
CID 60656778
3-[(2-chlorobenzoyl)amino]-1,1-diethylurea
CID 14173554

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide (CID 60670695) is 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide is CCN(CCO)C(=O)CNC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The InChIKey is PIMKXVRZWYSTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O3/c1-2-16(7-8-17)12(18)9-15-13(19)10-5-3-4-6-11(10)14/h3-6,17H,2,7-9H2,1H3,(H,15,19).
What are the key properties of 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide has a molecular weight of 284.74 g/mol, XLogP of 0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 60670695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).