2-[(4-acetamidophenyl)methylamino]acetamide

C11H15N3O2 — CID 16773031

IUPAC2-[(4-acetamidophenyl)methylamino]acetamide
SMILESCC(=O)Nc1ccc(CNCC(N)=O)cc1
InChIInChI=1S/C11H15N3O2/c1-8(15)14-10-4-2-9(3-5-10)6-13-7-11(12)16/h2-5,13H,6-7H2,1H3,(H2,12,16)(H,14,15)
InChIKeyDURCUCGAGZDNDV-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.22
Rot. Bonds5

About 2-[(4-acetamidophenyl)methylamino]acetamide

2-[(4-acetamidophenyl)methylamino]acetamide (PubChem CID 16773031) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[(4-acetamidophenyl)methylamino]acetamide.

Molecular Properties

Compound Name2-[(4-acetamidophenyl)methylamino]acetamide
PubChem CID16773031
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[(4-acetamidophenyl)methylamino]acetamide
SMILESCC(=O)Nc1ccc(CNCC(N)=O)cc1
InChIInChI=1S/C11H15N3O2/c1-8(15)14-10-4-2-9(3-5-10)6-13-7-11(12)16/h2-5,13H,6-7H2,1H3,(H2,12,16)(H,14,15)
InChIKeyDURCUCGAGZDNDV-UHFFFAOYSA-N
XLogP0.22
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-acetamidophenyl)methylamino]propanamide
CID 43553315
N-[4-[(2-methylprop-2-enylamino)methyl]phenyl]acetamide
CID 20518349
N-[4-[(2-aminoethylamino)methyl]phenyl]acetamide
CID 60887172
2-[(4-hydroxyphenyl)methylamino]acetamide
CID 16775960
N-(4-acetamidophenyl)-2-[(4-methoxyphenyl)methylamino]acetamide
CID 54838346
2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
CID 43754691
N-[4-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenyl]acetamide
CID 79352344
N-[4-[[(2-ethyl-2-methylsulfanylbutyl)amino]methyl]phenyl]acetamide
CID 103702075
N-[4-[[[1-(hydroxymethyl)cyclopropyl]methylamino]methyl]phenyl]acetamide
CID 79478656
N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide
CID 103735819
N-[4-[[(2-methylcyclopropyl)methylamino]methyl]phenyl]acetamide
CID 115594062
N-[4-[(pyridin-3-ylmethylamino)methyl]phenyl]acetamide
CID 27654042

Frequently Asked Questions

What is the IUPAC name of 2-[(4-acetamidophenyl)methylamino]acetamide?
The IUPAC name of 2-[(4-acetamidophenyl)methylamino]acetamide (CID 16773031) is 2-[(4-acetamidophenyl)methylamino]acetamide.
What is the SMILES notation for 2-[(4-acetamidophenyl)methylamino]acetamide?
The canonical SMILES for 2-[(4-acetamidophenyl)methylamino]acetamide is CC(=O)Nc1ccc(CNCC(N)=O)cc1.
What is the InChIKey of 2-[(4-acetamidophenyl)methylamino]acetamide?
The InChIKey is DURCUCGAGZDNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-8(15)14-10-4-2-9(3-5-10)6-13-7-11(12)16/h2-5,13H,6-7H2,1H3,(H2,12,16)(H,14,15).
What are the key properties of 2-[(4-acetamidophenyl)methylamino]acetamide?
2-[(4-acetamidophenyl)methylamino]acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.22, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-acetamidophenyl)methylamino]acetamide is sourced from PubChem (CID 16773031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).