N-benzyl-2-(methylcarbamoylamino)benzamide

C16H17N3O2 — CID 665300

IUPACN-benzyl-2-(methylcarbamoylamino)benzamide
SMILESCNC(=O)Nc1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C16H17N3O2/c1-17-16(21)19-14-10-6-5-9-13(14)15(20)18-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,18,20)(H2,17,19,21)
InChIKeyRKTVJSBXTYLOQV-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.37
Rot. Bonds4

About N-benzyl-2-(methylcarbamoylamino)benzamide

N-benzyl-2-(methylcarbamoylamino)benzamide (PubChem CID 665300) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-benzyl-2-(methylcarbamoylamino)benzamide.

Molecular Properties

Compound NameN-benzyl-2-(methylcarbamoylamino)benzamide
PubChem CID665300
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-benzyl-2-(methylcarbamoylamino)benzamide
SMILESCNC(=O)Nc1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C16H17N3O2/c1-17-16(21)19-14-10-6-5-9-13(14)15(20)18-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,18,20)(H2,17,19,21)
InChIKeyRKTVJSBXTYLOQV-UHFFFAOYSA-N
XLogP2.37
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(methylcarbamoylamino)benzamide?
The IUPAC name of N-benzyl-2-(methylcarbamoylamino)benzamide (CID 665300) is N-benzyl-2-(methylcarbamoylamino)benzamide.
What is the SMILES notation for N-benzyl-2-(methylcarbamoylamino)benzamide?
The canonical SMILES for N-benzyl-2-(methylcarbamoylamino)benzamide is CNC(=O)Nc1ccccc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(methylcarbamoylamino)benzamide?
The InChIKey is RKTVJSBXTYLOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-17-16(21)19-14-10-6-5-9-13(14)15(20)18-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,18,20)(H2,17,19,21).
What are the key properties of N-benzyl-2-(methylcarbamoylamino)benzamide?
N-benzyl-2-(methylcarbamoylamino)benzamide has a molecular weight of 283.33 g/mol, XLogP of 2.37, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(methylcarbamoylamino)benzamide is sourced from PubChem (CID 665300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).