1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide

C20H28N2O3 — CID 109145869

IUPAC1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCC(C(=O)NC3CCCC3)CC2)cc1
InChIInChI=1S/C20H28N2O3/c1-25-18-12-10-17(11-13-18)22-20(24)15-8-6-14(7-9-15)19(23)21-16-4-2-3-5-16/h10-16H,2-9H2,1H3,(H,21,23)(H,22,24)
InChIKeyCYMUZXXNQGDZOD-UHFFFAOYSA-N
MW344.45 g/mol
LogP3.50
Rot. Bonds5

About 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide

1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide (PubChem CID 109145869) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide
PubChem CID109145869
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC Name1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCC(C(=O)NC3CCCC3)CC2)cc1
InChIInChI=1S/C20H28N2O3/c1-25-18-12-10-17(11-13-18)22-20(24)15-8-6-14(7-9-15)19(23)21-16-4-2-3-5-16/h10-16H,2-9H2,1H3,(H,21,23)(H,22,24)
InChIKeyCYMUZXXNQGDZOD-UHFFFAOYSA-N
XLogP3.50
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-cyclohexyl-1-N-(4-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 6486998
N-[4-(4-methoxyanilino)phenyl]cyclohexanecarboxamide
CID 112987504
1-N-cyclopropyl-4-N-(4-ethoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109144778
4-amino-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 54928395
4-(cyclopentanecarbonylamino)-N-(4-methoxyphenyl)benzamide
CID 2677112
N-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145697
4-N-cyclopentyl-1-N-[2-(4-methoxyphenoxy)ethyl]cyclohexane-1,4-dicarboxamide
CID 109145817
1-N-cyclopentyl-4-N-[4-(diethylamino)phenyl]cyclohexane-1,4-dicarboxamide
CID 109145889
4-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 2288100
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]cyclopentanecarboxamide
CID 2649885
N-[(4-methoxyphenyl)carbamothioyl]cyclopentanecarboxamide
CID 4924408
1-N-cyclopentyl-4-N-(4-piperidin-1-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109145891

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide (CID 109145869) is 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide is COc1ccc(NC(=O)C2CCC(C(=O)NC3CCCC3)CC2)cc1.
What is the InChIKey of 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide?
The InChIKey is CYMUZXXNQGDZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-25-18-12-10-17(11-13-18)22-20(24)15-8-6-14(7-9-15)19(23)21-16-4-2-3-5-16/h10-16H,2-9H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide?
1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide has a molecular weight of 344.45 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopentyl-4-N-(4-methoxyphenyl)cyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 109145869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).