[4-(hydrazinecarbonyl)anilino]urea

C8H11N5O2 — CID 70606612

IUPAC[4-(hydrazinecarbonyl)anilino]urea
SMILESNNC(=O)c1ccc(NNC(N)=O)cc1
InChIInChI=1S/C8H11N5O2/c9-8(15)13-12-6-3-1-5(2-4-6)7(14)11-10/h1-4,12H,10H2,(H,11,14)(H3,9,13,15)
InChIKeyHZIPXGGAFHXPNO-UHFFFAOYSA-N
MW209.21 g/mol
LogP-0.71
Rot. Bonds3

About [4-(hydrazinecarbonyl)anilino]urea

[4-(hydrazinecarbonyl)anilino]urea (PubChem CID 70606612) has the molecular formula C8H11N5O2 and a molecular weight of 209.21 g/mol. Its IUPAC name is [4-(hydrazinecarbonyl)anilino]urea.

Molecular Properties

Compound Name[4-(hydrazinecarbonyl)anilino]urea
PubChem CID70606612
Molecular FormulaC8H11N5O2
Molecular Weight209.21 g/mol
Exact Mass209.09
IUPAC Name[4-(hydrazinecarbonyl)anilino]urea
SMILESNNC(=O)c1ccc(NNC(N)=O)cc1
InChIInChI=1S/C8H11N5O2/c9-8(15)13-12-6-3-1-5(2-4-6)7(14)11-10/h1-4,12H,10H2,(H,11,14)(H3,9,13,15)
InChIKeyHZIPXGGAFHXPNO-UHFFFAOYSA-N
XLogP-0.71
TPSA122.27 Ų
H-Bond Donors5
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-0.71
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of [4-(hydrazinecarbonyl)anilino]urea?
The IUPAC name of [4-(hydrazinecarbonyl)anilino]urea (CID 70606612) is [4-(hydrazinecarbonyl)anilino]urea.
What is the SMILES notation for [4-(hydrazinecarbonyl)anilino]urea?
The canonical SMILES for [4-(hydrazinecarbonyl)anilino]urea is NNC(=O)c1ccc(NNC(N)=O)cc1.
What is the InChIKey of [4-(hydrazinecarbonyl)anilino]urea?
The InChIKey is HZIPXGGAFHXPNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O2/c9-8(15)13-12-6-3-1-5(2-4-6)7(14)11-10/h1-4,12H,10H2,(H,11,14)(H3,9,13,15).
What are the key properties of [4-(hydrazinecarbonyl)anilino]urea?
[4-(hydrazinecarbonyl)anilino]urea has a molecular weight of 209.21 g/mol, XLogP of -0.71, 3 rotatable bonds, 5 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(hydrazinecarbonyl)anilino]urea is sourced from PubChem (CID 70606612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).