N-carbamoyl-N-(3-phenylphenyl)formamide

C14H12N2O2 — CID 91260072

IUPACN-carbamoyl-N-(3-phenylphenyl)formamide
SMILESNC(=O)N(C=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C14H12N2O2/c15-14(18)16(10-17)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,15,18)
InChIKeyZXYFXQVJSPJIFK-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.40
Rot. Bonds3

About N-carbamoyl-N-(3-phenylphenyl)formamide

N-carbamoyl-N-(3-phenylphenyl)formamide (PubChem CID 91260072) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-carbamoyl-N-(3-phenylphenyl)formamide.

Molecular Properties

Compound NameN-carbamoyl-N-(3-phenylphenyl)formamide
PubChem CID91260072
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC NameN-carbamoyl-N-(3-phenylphenyl)formamide
SMILESNC(=O)N(C=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C14H12N2O2/c15-14(18)16(10-17)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,15,18)
InChIKeyZXYFXQVJSPJIFK-UHFFFAOYSA-N
XLogP2.40
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 ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-N-(3-phenylphenyl)formamide?
The IUPAC name of N-carbamoyl-N-(3-phenylphenyl)formamide (CID 91260072) is N-carbamoyl-N-(3-phenylphenyl)formamide.
What is the SMILES notation for N-carbamoyl-N-(3-phenylphenyl)formamide?
The canonical SMILES for N-carbamoyl-N-(3-phenylphenyl)formamide is NC(=O)N(C=O)c1cccc(-c2ccccc2)c1.
What is the InChIKey of N-carbamoyl-N-(3-phenylphenyl)formamide?
The InChIKey is ZXYFXQVJSPJIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c15-14(18)16(10-17)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H,(H2,15,18).
What are the key properties of N-carbamoyl-N-(3-phenylphenyl)formamide?
N-carbamoyl-N-(3-phenylphenyl)formamide has a molecular weight of 240.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-N-(3-phenylphenyl)formamide is sourced from PubChem (CID 91260072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).