N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide

C22H21N3O3 — CID 2814073

IUPACN-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide
SMILESCc1cc(C)cc(NC(=O)Nc2ccc(NC(=O)c3ccccc3O)cc2)c1
InChIInChI=1S/C22H21N3O3/c1-14-11-15(2)13-18(12-14)25-22(28)24-17-9-7-16(8-10-17)23-21(27)19-5-3-4-6-20(19)26/h3-13,26H,1-2H3,(H,23,27)(H2,24,25,28)
InChIKeyYNLOLPHULVLKDY-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.91
Rot. Bonds4

About N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide

N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide (PubChem CID 2814073) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide
PubChem CID2814073
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide
SMILESCc1cc(C)cc(NC(=O)Nc2ccc(NC(=O)c3ccccc3O)cc2)c1
InChIInChI=1S/C22H21N3O3/c1-14-11-15(2)13-18(12-14)25-22(28)24-17-9-7-16(8-10-17)23-21(27)19-5-3-4-6-20(19)26/h3-13,26H,1-2H3,(H,23,27)(H2,24,25,28)
InChIKeyYNLOLPHULVLKDY-UHFFFAOYSA-N
XLogP4.91
TPSA90.46 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.91
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Analyze N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide 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

Salicylanilide
CID 6872
Osalmid
CID 4602
2-Hydroxy-N-(3-(trifluoromethyl)phenyl)benzamide
CID 68519
2-hydroxy-N-(4-methylphenyl)benzamide
CID 478805
N-2-Naphthylsalicylamide
CID 219325
N-(3-fluorophenyl)-2-hydroxybenzamide
CID 478808
N-(4-fluorophenyl)-2-hydroxybenzamide
CID 478809
N1-(3-{[(ethylamino)carbothioyl]amino}phenyl)-2-hydroxybenzamide
CID 2725436
N-(2,5-dimethylphenyl)-2-hydroxybenzamide
CID 657786
N-[4-hydroxy-3,5-di(propan-2-yl)phenyl]benzamide
CID 1548109
N-(3,5-bis(trifluoromethyl)phenyl)-2-hydroxybenzamide
CID 9975090
N-[3,5-bis(trifluoromethyl)phenyl]-5-fluoro-2-hydroxy-benzamide
CID 10067510

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide?
The IUPAC name of N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide (CID 2814073) is N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide.
What is the SMILES notation for N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide?
The canonical SMILES for N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide is Cc1cc(C)cc(NC(=O)Nc2ccc(NC(=O)c3ccccc3O)cc2)c1.
What is the InChIKey of N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide?
The InChIKey is YNLOLPHULVLKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-14-11-15(2)13-18(12-14)25-22(28)24-17-9-7-16(8-10-17)23-21(27)19-5-3-4-6-20(19)26/h3-13,26H,1-2H3,(H,23,27)(H2,24,25,28).
What are the key properties of N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide?
N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide has a molecular weight of 375.43 g/mol, XLogP of 4.91, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,5-dimethylphenyl)carbamoylamino]phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 2814073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).