N-[3-(hydrazinecarbonylamino)phenyl]acetamide

C9H12N4O2 — CID 82283644

IUPACN-[3-(hydrazinecarbonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)NN)c1
InChIInChI=1S/C9H12N4O2/c1-6(14)11-7-3-2-4-8(5-7)12-9(15)13-10/h2-5H,10H2,1H3,(H,11,14)(H2,12,13,15)
InChIKeyQGFBENSIPDRCJR-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.64
Rot. Bonds2

About N-[3-(hydrazinecarbonylamino)phenyl]acetamide

N-[3-(hydrazinecarbonylamino)phenyl]acetamide (PubChem CID 82283644) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is N-[3-(hydrazinecarbonylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(hydrazinecarbonylamino)phenyl]acetamide
PubChem CID82283644
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC NameN-[3-(hydrazinecarbonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)NN)c1
InChIInChI=1S/C9H12N4O2/c1-6(14)11-7-3-2-4-8(5-7)12-9(15)13-10/h2-5H,10H2,1H3,(H,11,14)(H2,12,13,15)
InChIKeyQGFBENSIPDRCJR-UHFFFAOYSA-N
XLogP0.64
TPSA96.25 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-amino-3-(3-hydroxyphenyl)urea
CID 23273555
N-[3-(2-methylprop-1-enylcarbamoylamino)phenyl]acetamide
CID 108909956
N-[3-[(4-bromophenyl)carbamoylamino]phenyl]acetamide
CID 6468047
N-[3-[2-[4-[(hydrazinecarbonylamino)methyl]phenyl]ethyl]phenyl]acetamide
CID 151709013
N-[3-[(3-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467465
N-[3-[[3-(dimethylamino)phenyl]carbamoylamino]phenyl]acetamide
CID 108884172
N'-(3-acetamidophenyl)-N-phenyloxamide
CID 45001278
N-(3-acetamidophenyl)-2-aminopropanamide
CID 24711020
N-[4-[(3-hydroxyphenyl)carbamoylamino]phenyl]acetamide
CID 108895676
N-[(3-acetamidophenyl)carbamoyl]-4-aminobenzamide
CID 108884186
N-[3-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]acetamide
CID 970620
acetohydrazide;N-phenylacetamide;hydrate
CID 174786539

Frequently Asked Questions

What is the IUPAC name of N-[3-(hydrazinecarbonylamino)phenyl]acetamide?
The IUPAC name of N-[3-(hydrazinecarbonylamino)phenyl]acetamide (CID 82283644) is N-[3-(hydrazinecarbonylamino)phenyl]acetamide.
What is the SMILES notation for N-[3-(hydrazinecarbonylamino)phenyl]acetamide?
The canonical SMILES for N-[3-(hydrazinecarbonylamino)phenyl]acetamide is CC(=O)Nc1cccc(NC(=O)NN)c1.
What is the InChIKey of N-[3-(hydrazinecarbonylamino)phenyl]acetamide?
The InChIKey is QGFBENSIPDRCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c1-6(14)11-7-3-2-4-8(5-7)12-9(15)13-10/h2-5H,10H2,1H3,(H,11,14)(H2,12,13,15).
What are the key properties of N-[3-(hydrazinecarbonylamino)phenyl]acetamide?
N-[3-(hydrazinecarbonylamino)phenyl]acetamide has a molecular weight of 208.22 g/mol, XLogP of 0.64, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(hydrazinecarbonylamino)phenyl]acetamide is sourced from PubChem (CID 82283644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).