(2-phenoxyphenyl)cyanamide

C13H10N2O — CID 62482258

IUPAC(2-phenoxyphenyl)cyanamide
SMILESN#CNc1ccccc1Oc1ccccc1
InChIInChI=1S/C13H10N2O/c14-10-15-12-8-4-5-9-13(12)16-11-6-2-1-3-7-11/h1-9,15H
InChIKeyVYJFURRSCLNUPP-UHFFFAOYSA-N
MW210.24 g/mol
LogP3.37
Rot. Bonds3

About (2-phenoxyphenyl)cyanamide

(2-phenoxyphenyl)cyanamide (PubChem CID 62482258) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is (2-phenoxyphenyl)cyanamide.

Molecular Properties

Compound Name(2-phenoxyphenyl)cyanamide
PubChem CID62482258
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name(2-phenoxyphenyl)cyanamide
SMILESN#CNc1ccccc1Oc1ccccc1
InChIInChI=1S/C13H10N2O/c14-10-15-12-8-4-5-9-13(12)16-11-6-2-1-3-7-11/h1-9,15H
InChIKeyVYJFURRSCLNUPP-UHFFFAOYSA-N
XLogP3.37
TPSA45.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}

Analyze (2-phenoxyphenyl)cyanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-2-phenoxyaniline
CID 22961955
2,6-diphenoxybenzonitrile
CID 71353957
2-anilino-6-phenoxybenzonitrile
CID 22136226
N-but-2-ynyl-2-phenoxyaniline
CID 62309532
2-cyano-N-(2-phenoxyphenyl)benzenesulfonamide
CID 26980043
N-but-3-ynyl-2-phenoxyaniline
CID 63657464
N,N-bis(2-cyanoethyl)-2-(2-phenoxyanilino)acetamide
CID 78822833
4,5-diphenoxybenzene-1,2-dicarbonitrile
CID 680327
N-[2-(2-phenoxyanilino)ethyl]acetamide
CID 103604146
N-(1,1-difluoropropan-2-yl)-2-phenoxyaniline
CID 102867685
2-[(2-phenoxyanilino)methyl]phenol
CID 43823583
3-[benzyl(cyanomethyl)amino]-N-(2-phenoxyphenyl)propanamide
CID 56525379

Frequently Asked Questions

What is the IUPAC name of (2-phenoxyphenyl)cyanamide?
The IUPAC name of (2-phenoxyphenyl)cyanamide (CID 62482258) is (2-phenoxyphenyl)cyanamide.
What is the SMILES notation for (2-phenoxyphenyl)cyanamide?
The canonical SMILES for (2-phenoxyphenyl)cyanamide is N#CNc1ccccc1Oc1ccccc1.
What is the InChIKey of (2-phenoxyphenyl)cyanamide?
The InChIKey is VYJFURRSCLNUPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c14-10-15-12-8-4-5-9-13(12)16-11-6-2-1-3-7-11/h1-9,15H.
What are the key properties of (2-phenoxyphenyl)cyanamide?
(2-phenoxyphenyl)cyanamide has a molecular weight of 210.24 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenoxyphenyl)cyanamide is sourced from PubChem (CID 62482258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).