4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide

C20H20ClFN2O2 — CID 109150860

IUPAC4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
SMILESO=C(Nc1ccccc1F)C1CCC(C(=O)Nc2ccccc2Cl)CC1
InChIInChI=1S/C20H20ClFN2O2/c21-15-5-1-3-7-17(15)23-19(25)13-9-11-14(12-10-13)20(26)24-18-8-4-2-6-16(18)22/h1-8,13-14H,9-12H2,(H,23,25)(H,24,26)
InChIKeyKMHKPVNEBMFOPI-UHFFFAOYSA-N
MW374.84 g/mol
LogP4.86
Rot. Bonds4

About 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide

4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide (PubChem CID 109150860) has the molecular formula C20H20ClFN2O2 and a molecular weight of 374.84 g/mol. Its IUPAC name is 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
PubChem CID109150860
Molecular FormulaC20H20ClFN2O2
Molecular Weight374.84 g/mol
Exact Mass374.12
IUPAC Name4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
SMILESO=C(Nc1ccccc1F)C1CCC(C(=O)Nc2ccccc2Cl)CC1
InChIInChI=1S/C20H20ClFN2O2/c21-15-5-1-3-7-17(15)23-19(25)13-9-11-14(12-10-13)20(26)24-18-8-4-2-6-16(18)22/h1-8,13-14H,9-12H2,(H,23,25)(H,24,26)
InChIKeyKMHKPVNEBMFOPI-UHFFFAOYSA-N
XLogP4.86
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.84
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)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

N-(2-chlorophenyl)cyclopropanecarboxamide
CID 849222
4-amino-N-(2-fluorophenyl)cyclohexane-1-carboxamide
CID 60847748
1-N-[(2-chlorophenyl)methyl]-4-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109148495
N-(2-chlorophenyl)thiane-4-carboxamide
CID 110858755
N-(2-fluorophenyl)-4-(piperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146012
1-[(2-chloro-6-fluorophenyl)methyl]-N-(2-chlorophenyl)piperidine-4-carboxamide
CID 45018841
4-N-(2-chlorophenyl)-1-N-(2-cyanophenyl)cyclohexane-1,4-dicarboxamide
CID 109150947
4-N-(2-chlorophenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109150938
N-(2,3-dichlorophenyl)cyclopropanecarboxamide
CID 4652086
N,1-bis(2-fluorophenyl)piperidine-4-carboxamide
CID 17152573
4-N-(2-fluorophenyl)-1-N-(2-propan-2-yloxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109150874
(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
CID 94915553

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide?
The IUPAC name of 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide (CID 109150860) is 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide?
The canonical SMILES for 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide is O=C(Nc1ccccc1F)C1CCC(C(=O)Nc2ccccc2Cl)CC1.
What is the InChIKey of 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide?
The InChIKey is KMHKPVNEBMFOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClFN2O2/c21-15-5-1-3-7-17(15)23-19(25)13-9-11-14(12-10-13)20(26)24-18-8-4-2-6-16(18)22/h1-8,13-14H,9-12H2,(H,23,25)(H,24,26).
What are the key properties of 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide?
4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide has a molecular weight of 374.84 g/mol, XLogP of 4.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 109150860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).