N-cyclohexyl-7-methoxyquinoline-3-carboxamide

C17H20N2O2 — CID 155513454

IUPACN-cyclohexyl-7-methoxyquinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC3CCCCC3)cnc2c1
InChIInChI=1S/C17H20N2O2/c1-21-15-8-7-12-9-13(11-18-16(12)10-15)17(20)19-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,19,20)
InChIKeyOEAREVMLYABMSP-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.31
Rot. Bonds3

About N-cyclohexyl-7-methoxyquinoline-3-carboxamide

N-cyclohexyl-7-methoxyquinoline-3-carboxamide (PubChem CID 155513454) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-cyclohexyl-7-methoxyquinoline-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-7-methoxyquinoline-3-carboxamide
PubChem CID155513454
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-cyclohexyl-7-methoxyquinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC3CCCCC3)cnc2c1
InChIInChI=1S/C17H20N2O2/c1-21-15-8-7-12-9-13(11-18-16(12)10-15)17(20)19-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,19,20)
InChIKeyOEAREVMLYABMSP-UHFFFAOYSA-N
XLogP3.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-7-methoxyquinoline-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-7-methoxyquinoline-3-carboxamide?
The IUPAC name of N-cyclohexyl-7-methoxyquinoline-3-carboxamide (CID 155513454) is N-cyclohexyl-7-methoxyquinoline-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-7-methoxyquinoline-3-carboxamide?
The canonical SMILES for N-cyclohexyl-7-methoxyquinoline-3-carboxamide is COc1ccc2cc(C(=O)NC3CCCCC3)cnc2c1.
What is the InChIKey of N-cyclohexyl-7-methoxyquinoline-3-carboxamide?
The InChIKey is OEAREVMLYABMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-21-15-8-7-12-9-13(11-18-16(12)10-15)17(20)19-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,19,20).
What are the key properties of N-cyclohexyl-7-methoxyquinoline-3-carboxamide?
N-cyclohexyl-7-methoxyquinoline-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-7-methoxyquinoline-3-carboxamide is sourced from PubChem (CID 155513454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).