N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide

C12H18N2O3 — CID 21495863

IUPACN-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide
SMILESCCN(CCO)c1cccc(NC(=O)CO)c1
InChIInChI=1S/C12H18N2O3/c1-2-14(6-7-15)11-5-3-4-10(8-11)13-12(17)9-16/h3-5,8,15-16H,2,6-7,9H2,1H3,(H,13,17)
InChIKeyLVCAXPHGLWNZAA-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.44
Rot. Bonds6

About N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide

N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide (PubChem CID 21495863) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide
PubChem CID21495863
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide
SMILESCCN(CCO)c1cccc(NC(=O)CO)c1
InChIInChI=1S/C12H18N2O3/c1-2-14(6-7-15)11-5-3-4-10(8-11)13-12(17)9-16/h3-5,8,15-16H,2,6-7,9H2,1H3,(H,13,17)
InChIKeyLVCAXPHGLWNZAA-UHFFFAOYSA-N
XLogP0.44
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[ethyl(2-propan-2-yloxyethyl)amino]phenyl]propanamide
CID 71331392
N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-4-hydroxybutanamide
CID 79204146
N-[3-[ethyl(methyl)amino]phenyl]butanamide
CID 91181927
ethane;2-(N-ethyl-3-methylanilino)ethanol
CID 142945476
3-[ethyl(2-hydroxyethyl)amino]benzaldehyde
CID 84758573
2-(N-ethylanilino)-N-(3-phenylphenyl)acetamide
CID 13221983
2-(N-ethylanilino)ethanol;2-(N-ethyl-3-methylanilino)ethanol
CID 67646691
N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide
CID 52686374
N-[3-(aminomethyl)phenyl]-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 54879755
N-(3-chlorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109008467
N-(3-aminophenyl)-2-(N-ethylanilino)acetamide
CID 16790236
3-(ethylamino)-N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]propanamide
CID 62834910

Frequently Asked Questions

What is the IUPAC name of N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide?
The IUPAC name of N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide (CID 21495863) is N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide.
What is the SMILES notation for N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide?
The canonical SMILES for N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide is CCN(CCO)c1cccc(NC(=O)CO)c1.
What is the InChIKey of N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide?
The InChIKey is LVCAXPHGLWNZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-2-14(6-7-15)11-5-3-4-10(8-11)13-12(17)9-16/h3-5,8,15-16H,2,6-7,9H2,1H3,(H,13,17).
What are the key properties of N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide?
N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide has a molecular weight of 238.29 g/mol, XLogP of 0.44, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[ethyl(2-hydroxyethyl)amino]phenyl]-2-hydroxyacetamide is sourced from PubChem (CID 21495863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).