N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide

C14H20N2O4 — CID 60686695

IUPACN-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(CCO)CCO)c1
InChIInChI=1S/C14H20N2O4/c1-11(19)12-3-2-4-13(9-12)15-14(20)10-16(5-7-17)6-8-18/h2-4,9,17-18H,5-8,10H2,1H3,(H,15,20)
InChIKeyZBFIWSZPWZAYMC-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.11
Rot. Bonds8

About N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide

N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide (PubChem CID 60686695) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
PubChem CID60686695
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(CCO)CCO)c1
InChIInChI=1S/C14H20N2O4/c1-11(19)12-3-2-4-13(9-12)15-14(20)10-16(5-7-17)6-8-18/h2-4,9,17-18H,5-8,10H2,1H3,(H,15,20)
InChIKeyZBFIWSZPWZAYMC-UHFFFAOYSA-N
XLogP0.11
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-bromophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60692729
2-[[2-(3-acetylanilino)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 9432878
3-(3-acetylphenyl)-1,1-bis(2-hydroxyethyl)urea
CID 61347604
N-(3-acetylphenyl)-2-[bis(furan-2-ylmethyl)amino]acetamide
CID 8840674
N-(3-acetylphenyl)-2-[acetyl(propyl)amino]acetamide
CID 113158044
N-(3-acetylphenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78962325
N-(3-acetylphenyl)-2-(2-hydroxyethoxy)acetamide
CID 110678314
N-(3-acetylphenyl)propanamide
CID 903063
N-(3-acetylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 115666921
N-(3-fluorophenyl)-2-[2-hydroxyethyl(pentyl)amino]acetamide
CID 111120327
2-[2-hydroxyethyl(propyl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 110881655
N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide
CID 62334507

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide (CID 60686695) is N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide is CC(=O)c1cccc(NC(=O)CN(CCO)CCO)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide?
The InChIKey is ZBFIWSZPWZAYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-11(19)12-3-2-4-13(9-12)15-14(20)10-16(5-7-17)6-8-18/h2-4,9,17-18H,5-8,10H2,1H3,(H,15,20).
What are the key properties of N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide?
N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide has a molecular weight of 280.32 g/mol, XLogP of 0.11, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[bis(2-hydroxyethyl)amino]acetamide is sourced from PubChem (CID 60686695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).