1-(4-formylphenyl)-1-phenylurea

C14H12N2O2 — CID 57262410

IUPAC1-(4-formylphenyl)-1-phenylurea
SMILESNC(=O)N(c1ccccc1)c1ccc(C=O)cc1
InChIInChI=1S/C14H12N2O2/c15-14(18)16(12-4-2-1-3-5-12)13-8-6-11(10-17)7-9-13/h1-10H,(H2,15,18)
InChIKeyOKWQKYOMXXIJOO-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.72
Rot. Bonds3

About 1-(4-formylphenyl)-1-phenylurea

1-(4-formylphenyl)-1-phenylurea (PubChem CID 57262410) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 1-(4-formylphenyl)-1-phenylurea.

Molecular Properties

Compound Name1-(4-formylphenyl)-1-phenylurea
PubChem CID57262410
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name1-(4-formylphenyl)-1-phenylurea
SMILESNC(=O)N(c1ccccc1)c1ccc(C=O)cc1
InChIInChI=1S/C14H12N2O2/c15-14(18)16(12-4-2-1-3-5-12)13-8-6-11(10-17)7-9-13/h1-10H,(H2,15,18)
InChIKeyOKWQKYOMXXIJOO-UHFFFAOYSA-N
XLogP2.72
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1-diphenylurea
CID 174849888
1-[4-(2-oxoethyl)phenyl]-1-phenylurea
CID 91426853
1-phenyl-1-(4-phenylphenyl)urea
CID 90698606
4-(N-[(3E)-hexa-1,3,5-trien-3-yl]anilino)benzaldehyde
CID 143629119
butane;1,1-diphenylurea
CID 70397101
benzene;terephthalaldehyde
CID 163498156
benzaldehyde;carbonic acid;hydrate
CID 173060917
4-(N-benzyl-4-formylanilino)benzaldehyde
CID 18955916
N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;4-ethenyl-N-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)benzaldehyde
CID 160992950
2-(N-carbamoylanilino)benzamide
CID 68726010
1-(2-fluorophenyl)-1-phenylurea
CID 150840267
1,1-bis(4-bromophenyl)urea;hydrochloride
CID 172731667

Frequently Asked Questions

What is the IUPAC name of 1-(4-formylphenyl)-1-phenylurea?
The IUPAC name of 1-(4-formylphenyl)-1-phenylurea (CID 57262410) is 1-(4-formylphenyl)-1-phenylurea.
What is the SMILES notation for 1-(4-formylphenyl)-1-phenylurea?
The canonical SMILES for 1-(4-formylphenyl)-1-phenylurea is NC(=O)N(c1ccccc1)c1ccc(C=O)cc1.
What is the InChIKey of 1-(4-formylphenyl)-1-phenylurea?
The InChIKey is OKWQKYOMXXIJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c15-14(18)16(12-4-2-1-3-5-12)13-8-6-11(10-17)7-9-13/h1-10H,(H2,15,18).
What are the key properties of 1-(4-formylphenyl)-1-phenylurea?
1-(4-formylphenyl)-1-phenylurea has a molecular weight of 240.26 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-formylphenyl)-1-phenylurea is sourced from PubChem (CID 57262410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).