2-[(2-chloroacetyl)amino]acetamide

C4H7ClN2O2 — CID 28605345

IUPAC2-[(2-chloroacetyl)amino]acetamide
SMILESNC(=O)CNC(=O)CCl
InChIInChI=1S/C4H7ClN2O2/c5-1-4(9)7-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9)
InChIKeyFRAOLWYUJYJMKW-UHFFFAOYSA-N
MW150.56 g/mol
LogP-1.17
Rot. Bonds3

About 2-[(2-chloroacetyl)amino]acetamide

2-[(2-chloroacetyl)amino]acetamide (PubChem CID 28605345) has the molecular formula C4H7ClN2O2 and a molecular weight of 150.56 g/mol. Its IUPAC name is 2-[(2-chloroacetyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-chloroacetyl)amino]acetamide
PubChem CID28605345
Molecular FormulaC4H7ClN2O2
Molecular Weight150.56 g/mol
Exact Mass150.02
IUPAC Name2-[(2-chloroacetyl)amino]acetamide
SMILESNC(=O)CNC(=O)CCl
InChIInChI=1S/C4H7ClN2O2/c5-1-4(9)7-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9)
InChIKeyFRAOLWYUJYJMKW-UHFFFAOYSA-N
XLogP-1.17
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.56
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-[(2-amino-2-oxoethyl)amino]-3-oxopropanoic acid
CID 62230553
N-[(carbamoylamino)methyl]-2-chloroacetamide
CID 175324438
ethane;2-[[2-(methylamino)acetyl]amino]acetamide
CID 168928174
2-[[2-(dimethylamino)acetyl]amino]acetamide
CID 14799394
2-[(2-chloroacetyl)amino]-N-(2-oxoethyl)acetamide
CID 173312497
N-(2-amino-2-oxoethyl)-4-fluorobutanamide
CID 57129132
N-(2-amino-2-oxoethyl)pentanamide
CID 12878232
2-chloro-N-(iodomethyl)acetamide
CID 89347854
tert-butyl N-[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]carbamate
CID 14236095
2-[[2-[[2-(propan-2-ylamino)acetyl]amino]acetyl]amino]acetamide
CID 174356714
N-(2-amino-2-oxoethyl)-3-methylsulfanylpropanamide
CID 60668278
2-[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]sulfanylacetic acid
CID 115573216

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloroacetyl)amino]acetamide?
The IUPAC name of 2-[(2-chloroacetyl)amino]acetamide (CID 28605345) is 2-[(2-chloroacetyl)amino]acetamide.
What is the SMILES notation for 2-[(2-chloroacetyl)amino]acetamide?
The canonical SMILES for 2-[(2-chloroacetyl)amino]acetamide is NC(=O)CNC(=O)CCl.
What is the InChIKey of 2-[(2-chloroacetyl)amino]acetamide?
The InChIKey is FRAOLWYUJYJMKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7ClN2O2/c5-1-4(9)7-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9).
What are the key properties of 2-[(2-chloroacetyl)amino]acetamide?
2-[(2-chloroacetyl)amino]acetamide has a molecular weight of 150.56 g/mol, XLogP of -1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloroacetyl)amino]acetamide is sourced from PubChem (CID 28605345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).