2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide

C11H15N3O3 — CID 62923312

IUPAC2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide
SMILESNC(=O)CN(CC(N)=O)c1ccccc1CO
InChIInChI=1S/C11H15N3O3/c12-10(16)5-14(6-11(13)17)9-4-2-1-3-8(9)7-15/h1-4,15H,5-7H2,(H2,12,16)(H2,13,17)
InChIKeyAIMDJQUHYYWAPO-UHFFFAOYSA-N
MW237.26 g/mol
LogP-1.04
Rot. Bonds6

About 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide

2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide (PubChem CID 62923312) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide.

Molecular Properties

Compound Name2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide
PubChem CID62923312
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide
SMILESNC(=O)CN(CC(N)=O)c1ccccc1CO
InChIInChI=1S/C11H15N3O3/c12-10(16)5-14(6-11(13)17)9-4-2-1-3-8(9)7-15/h1-4,15H,5-7H2,(H2,12,16)(H2,13,17)
InChIKeyAIMDJQUHYYWAPO-UHFFFAOYSA-N
XLogP-1.04
TPSA109.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[N-butyl-2-(hydroxymethyl)anilino]acetamide
CID 55003388
2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide
CID 63072276
2-[2-(hydroxymethyl)-N-methylanilino]-N-methylacetamide
CID 43375132
[2-[bis(2-methylpropyl)amino]phenyl]methanol
CID 61378074
[2-(hydroxymethyl)phenyl]-methylcarbamic acid
CID 18370050
2-(3-amino-N-(2-amino-2-oxoethyl)-2-methylanilino)acetamide
CID 63061902
2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide
CID 104540322
2-(2-amino-N-(2-amino-2-oxoethyl)-3-methylanilino)acetamide
CID 114041266
2-[2-(aminomethyl)-N-(2-amino-2-oxoethyl)-4-chloroanilino]acetamide
CID 62923094
2-[N-(2-amino-2-oxoethyl)-4-(hydroxymethyl)anilino]acetamide
CID 62923495
[2-(hydroxymethyl)phenyl]-methylsulfonylcarbamic acid
CID 89479786
tert-butyl N-[2-(hydroxymethyl)phenyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 121232071

Frequently Asked Questions

What is the IUPAC name of 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide?
The IUPAC name of 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide (CID 62923312) is 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide.
What is the SMILES notation for 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide?
The canonical SMILES for 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide is NC(=O)CN(CC(N)=O)c1ccccc1CO.
What is the InChIKey of 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide?
The InChIKey is AIMDJQUHYYWAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c12-10(16)5-14(6-11(13)17)9-4-2-1-3-8(9)7-15/h1-4,15H,5-7H2,(H2,12,16)(H2,13,17).
What are the key properties of 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide?
2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide has a molecular weight of 237.26 g/mol, XLogP of -1.04, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide is sourced from PubChem (CID 62923312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).