1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide

C22H26N2O3 — CID 109150432

IUPAC1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCC(C(=O)Nc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-15-4-3-5-19(14-15)24-22(26)17-8-6-16(7-9-17)21(25)23-18-10-12-20(27-2)13-11-18/h3-5,10-14,16-17H,6-9H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyDSPVCHLEZMBCEZ-UHFFFAOYSA-N
MW366.46 g/mol
LogP4.39
Rot. Bonds5

About 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide

1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide (PubChem CID 109150432) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
PubChem CID109150432
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCC(C(=O)Nc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-15-4-3-5-19(14-15)24-22(26)17-8-6-16(7-9-17)21(25)23-18-10-12-20(27-2)13-11-18/h3-5,10-14,16-17H,6-9H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyDSPVCHLEZMBCEZ-UHFFFAOYSA-N
XLogP4.39
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide 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

1-N-[(4-methoxyphenyl)methyl]-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109148585
4-N-(2,5-dimethoxyphenyl)-1-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150438
N-[4-(3-methylanilino)phenyl]cyclopropanecarboxamide
CID 112985938
4-N-(3,5-dimethylphenyl)-1-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150418
1-N-(4-cyanophenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150457
N-[3-[[(4-methoxyphenyl)carbamoylamino]methyl]phenyl]cyclopropanecarboxamide
CID 30940006
4-N-(3-acetylphenyl)-1-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150441
4-amino-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 54928395
4-methyl-N-[4-(3-methylphenoxy)phenyl]cyclohexane-1-carboxamide
CID 4139874
4-amino-N-(3-methoxyphenyl)cyclohexane-1-carboxamide
CID 60848992
1-N-(1,3-benzodioxol-5-yl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150450
N-[3-(cyclobutanecarbonylamino)phenyl]-4-methoxybenzamide
CID 56948594

Frequently Asked Questions

What is the IUPAC name of 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide?
The IUPAC name of 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide (CID 109150432) is 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide?
The canonical SMILES for 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide is COc1ccc(NC(=O)C2CCC(C(=O)Nc3cccc(C)c3)CC2)cc1.
What is the InChIKey of 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide?
The InChIKey is DSPVCHLEZMBCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-15-4-3-5-19(14-15)24-22(26)17-8-6-16(7-9-17)21(25)23-18-10-12-20(27-2)13-11-18/h3-5,10-14,16-17H,6-9H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide?
1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide has a molecular weight of 366.46 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4-methoxyphenyl)-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 109150432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).