4-acetamido-N,N-bis(2-hydroxyethyl)benzamide

C13H18N2O4 — CID 60653074

IUPAC4-acetamido-N,N-bis(2-hydroxyethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)N(CCO)CCO)cc1
InChIInChI=1S/C13H18N2O4/c1-10(18)14-12-4-2-11(3-5-12)13(19)15(6-8-16)7-9-17/h2-5,16-17H,6-9H2,1H3,(H,14,18)
InChIKeyPLZAGLLAWXYBQJ-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.07
Rot. Bonds6

About 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide

4-acetamido-N,N-bis(2-hydroxyethyl)benzamide (PubChem CID 60653074) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name4-acetamido-N,N-bis(2-hydroxyethyl)benzamide
PubChem CID60653074
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name4-acetamido-N,N-bis(2-hydroxyethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)N(CCO)CCO)cc1
InChIInChI=1S/C13H18N2O4/c1-10(18)14-12-4-2-11(3-5-12)13(19)15(6-8-16)7-9-17/h2-5,16-17H,6-9H2,1H3,(H,14,18)
InChIKeyPLZAGLLAWXYBQJ-UHFFFAOYSA-N
XLogP0.07
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-4-(phenylcarbamoylamino)benzamide
CID 78821680
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426
4-acetamido-N-ethyl-N-(2-methylprop-2-enyl)benzamide
CID 37012021
3-[2-hydroxyethyl-(4-methylbenzoyl)amino]propanoic acid
CID 82324694
4-(carbamoylamino)-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 115776053
N,N-bis(2-hydroxyethyl)-4-(sulfanylmethyl)benzamide
CID 143150014
5-acetamido-2-fluoro-N-(2-hydroxyethyl)-N-propylbenzamide
CID 110903029
4-acetamido-N-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110757168
ethane;N-(2-hydroxyethyl)-4-methyl-N-propylbenzamide
CID 176553147
N,N-bis(2-hydroxyethyl)-4-(methoxymethyl)benzamide
CID 61235842
4-amino-N-(2-hydroxyethyl)-N-propylbenzamide
CID 60946109
4-(dimethylsulfamoyl)-N,N-bis(2-hydroxyethyl)benzamide
CID 60655214

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide?
The IUPAC name of 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide (CID 60653074) is 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide.
What is the SMILES notation for 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide?
The canonical SMILES for 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide is CC(=O)Nc1ccc(C(=O)N(CCO)CCO)cc1.
What is the InChIKey of 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide?
The InChIKey is PLZAGLLAWXYBQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-10(18)14-12-4-2-11(3-5-12)13(19)15(6-8-16)7-9-17/h2-5,16-17H,6-9H2,1H3,(H,14,18).
What are the key properties of 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide?
4-acetamido-N,N-bis(2-hydroxyethyl)benzamide has a molecular weight of 266.30 g/mol, XLogP of 0.07, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N,N-bis(2-hydroxyethyl)benzamide is sourced from PubChem (CID 60653074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).