benzene;benzylurea;hydrazine

C14H20N4O — CID 68793593

IUPACbenzene;benzylurea;hydrazine
SMILESNC(=O)NCc1ccccc1.NN.c1ccccc1
InChIInChI=1S/C8H10N2O.C6H6.H4N2/c9-8(11)10-6-7-4-2-1-3-5-7;1-2-4-6-5-3-1;1-2/h1-5H,6H2,(H3,9,10,11);1-6H;1-2H2
InChIKeyDHNWQVINBCSDQF-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.36
Rot. Bonds2

About benzene;benzylurea;hydrazine

benzene;benzylurea;hydrazine (PubChem CID 68793593) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is benzene;benzylurea;hydrazine.

Molecular Properties

Compound Namebenzene;benzylurea;hydrazine
PubChem CID68793593
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Namebenzene;benzylurea;hydrazine
SMILESNC(=O)NCc1ccccc1.NN.c1ccccc1
InChIInChI=1S/C8H10N2O.C6H6.H4N2/c9-8(11)10-6-7-4-2-1-3-5-7;1-2-4-6-5-3-1;1-2/h1-5H,6H2,(H3,9,10,11);1-6H;1-2H2
InChIKeyDHNWQVINBCSDQF-UHFFFAOYSA-N
XLogP1.36
TPSA107.16 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-benzyloxamide
CID 561416
N'-benzylbutanediamide
CID 4682951
N-benzyl-2-oxopentanediamide
CID 162387847
5-(benzylcarbamoylamino)pentanamide
CID 106235188
N-benzyl-2-methylprop-2-enamide;hydrazine
CID 157480946
(3-methylphenyl)methylurea
CID 60776531
(3-ethylphenyl)methylurea
CID 70298508
3-[(carbamoylamino)methyl]benzamide
CID 166184789
3-benzyl-1-hydroxy-1-methylurea
CID 22900753
ethane;pyridin-4-ylmethylurea
CID 144877282
N-benzyl-2-hydrazinylacetamide
CID 15514349
N-benzylacetamide;ethanamine
CID 22257034

Frequently Asked Questions

What is the IUPAC name of benzene;benzylurea;hydrazine?
The IUPAC name of benzene;benzylurea;hydrazine (CID 68793593) is benzene;benzylurea;hydrazine.
What is the SMILES notation for benzene;benzylurea;hydrazine?
The canonical SMILES for benzene;benzylurea;hydrazine is NC(=O)NCc1ccccc1.NN.c1ccccc1.
What is the InChIKey of benzene;benzylurea;hydrazine?
The InChIKey is DHNWQVINBCSDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O.C6H6.H4N2/c9-8(11)10-6-7-4-2-1-3-5-7;1-2-4-6-5-3-1;1-2/h1-5H,6H2,(H3,9,10,11);1-6H;1-2H2.
What are the key properties of benzene;benzylurea;hydrazine?
benzene;benzylurea;hydrazine has a molecular weight of 260.34 g/mol, XLogP of 1.36, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;benzylurea;hydrazine is sourced from PubChem (CID 68793593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).