N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide

C19H23N3O2 — CID 24604643

IUPACN-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
SMILESCc1ccc(CNC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C19H23N3O2/c1-13-5-8-16(9-6-13)11-20-19(24)21-12-18(23)22-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,22,23)(H2,20,21,24)
InChIKeyIMOFEEXMHAKPFE-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.05
Rot. Bonds5

About N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide

N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide (PubChem CID 24604643) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
PubChem CID24604643
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
SMILESCc1ccc(CNC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C19H23N3O2/c1-13-5-8-16(9-6-13)11-20-19(24)21-12-18(23)22-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,22,23)(H2,20,21,24)
InChIKeyIMOFEEXMHAKPFE-UHFFFAOYSA-N
XLogP3.05
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide (CID 24604643) is N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide is Cc1ccc(CNC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide?
The InChIKey is IMOFEEXMHAKPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13-5-8-16(9-6-13)11-20-19(24)21-12-18(23)22-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,22,23)(H2,20,21,24).
What are the key properties of N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide?
N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.05, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide is sourced from PubChem (CID 24604643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).