1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide

C19H20Cl2N2O2 — CID 100771662

IUPAC1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(c3ccc(Cl)cc3Cl)CCCCC2)cn1
InChIInChI=1S/C19H20Cl2N2O2/c1-25-17-8-6-14(12-22-17)23-18(24)19(9-3-2-4-10-19)15-7-5-13(20)11-16(15)21/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,24)
InChIKeyZBRTWDKUXFOBNV-UHFFFAOYSA-N
MW379.29 g/mol
LogP5.24
Rot. Bonds4

About 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide

1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide (PubChem CID 100771662) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide
PubChem CID100771662
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC Name1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(c3ccc(Cl)cc3Cl)CCCCC2)cn1
InChIInChI=1S/C19H20Cl2N2O2/c1-25-17-8-6-14(12-22-17)23-18(24)19(9-3-2-4-10-19)15-7-5-13(20)11-16(15)21/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,24)
InChIKeyZBRTWDKUXFOBNV-UHFFFAOYSA-N
XLogP5.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.29
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide 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-(2-chlorophenyl)-N-(6-propoxy-3-pyridinyl)cyclohexane-1-carboxamide
CID 100771541
methyl 5-[[1-(2,4-dichlorophenyl)cyclohexanecarbonyl]amino]-2-methoxybenzoate
CID 100747148
N-(6-butoxy-5-methyl-3-pyridinyl)-1-(2,4-dichlorophenyl)cyclohexane-1-carboxamide
CID 100771758
N-(3-chloro-4-ethoxyphenyl)-1-(2,4-dichlorophenyl)cyclopentane-1-carboxamide
CID 100668194
1-(2,4-dichlorophenyl)-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclohexane-1-carboxamide
CID 100677257
1-(2,4-dichlorophenyl)-N-(4-ethoxy-3,5-dimethylphenyl)cyclopentane-1-carboxamide
CID 100668010
1-(2,4-dichlorophenyl)-N-(2-methyl-6-propoxy-3-pyridinyl)cyclohexane-1-carboxamide
CID 100771719
1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide
CID 55037854
methyl 1-(2,4-dichlorophenyl)cyclopentane-1-carboxylate
CID 3454678
N-(4-butoxy-3-cyanophenyl)-1-(2,4-dichlorophenyl)cyclopentane-1-carboxamide
CID 100743841
1-(4-chlorophenyl)-N-[6-[2-(dimethylamino)ethoxy]-3-pyridinyl]cyclohexane-1-carboxamide
CID 100781335
ethyl 2-butoxy-5-[[1-(2,4-dichlorophenyl)cyclopentanecarbonyl]amino]benzoate
CID 100743761

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide (CID 100771662) is 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide is COc1ccc(NC(=O)C2(c3ccc(Cl)cc3Cl)CCCCC2)cn1.
What is the InChIKey of 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide?
The InChIKey is ZBRTWDKUXFOBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c1-25-17-8-6-14(12-22-17)23-18(24)19(9-3-2-4-10-19)15-7-5-13(20)11-16(15)21/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,24).
What are the key properties of 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide?
1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide has a molecular weight of 379.29 g/mol, XLogP of 5.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-N-(6-methoxy-3-pyridinyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 100771662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).