2-amino-N-carbamoyl-N-phenylbenzamide

C14H13N3O2 — CID 175153164

IUPAC2-amino-N-carbamoyl-N-phenylbenzamide
SMILESNC(=O)N(C(=O)c1ccccc1N)c1ccccc1
InChIInChI=1S/C14H13N3O2/c15-12-9-5-4-8-11(12)13(18)17(14(16)19)10-6-2-1-3-7-10/h1-9H,15H2,(H2,16,19)
InChIKeyMWSDUCQRWXILIT-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.99
Rot. Bonds2

About 2-amino-N-carbamoyl-N-phenylbenzamide

2-amino-N-carbamoyl-N-phenylbenzamide (PubChem CID 175153164) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-amino-N-carbamoyl-N-phenylbenzamide.

Molecular Properties

Compound Name2-amino-N-carbamoyl-N-phenylbenzamide
PubChem CID175153164
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name2-amino-N-carbamoyl-N-phenylbenzamide
SMILESNC(=O)N(C(=O)c1ccccc1N)c1ccccc1
InChIInChI=1S/C14H13N3O2/c15-12-9-5-4-8-11(12)13(18)17(14(16)19)10-6-2-1-3-7-10/h1-9H,15H2,(H2,16,19)
InChIKeyMWSDUCQRWXILIT-UHFFFAOYSA-N
XLogP1.99
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-carbamoyl-N-phenylbenzamide?
The IUPAC name of 2-amino-N-carbamoyl-N-phenylbenzamide (CID 175153164) is 2-amino-N-carbamoyl-N-phenylbenzamide.
What is the SMILES notation for 2-amino-N-carbamoyl-N-phenylbenzamide?
The canonical SMILES for 2-amino-N-carbamoyl-N-phenylbenzamide is NC(=O)N(C(=O)c1ccccc1N)c1ccccc1.
What is the InChIKey of 2-amino-N-carbamoyl-N-phenylbenzamide?
The InChIKey is MWSDUCQRWXILIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c15-12-9-5-4-8-11(12)13(18)17(14(16)19)10-6-2-1-3-7-10/h1-9H,15H2,(H2,16,19).
What are the key properties of 2-amino-N-carbamoyl-N-phenylbenzamide?
2-amino-N-carbamoyl-N-phenylbenzamide has a molecular weight of 255.28 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-carbamoyl-N-phenylbenzamide is sourced from PubChem (CID 175153164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).