N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide

C24H25N3O3 — CID 11697052

IUPACN-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)Nc2cccnc2C(=O)NOC2CCCCC2)c2ccccc12
InChIInChI=1S/C24H25N3O3/c1-16-13-14-20(19-11-6-5-10-18(16)19)23(28)26-21-12-7-15-25-22(21)24(29)27-30-17-8-3-2-4-9-17/h5-7,10-15,17H,2-4,8-9H2,1H3,(H,26,28)(H,27,29)
InChIKeyCOGOZBAVIBWSIA-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.79
Rot. Bonds5

About N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide

N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide (PubChem CID 11697052) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide
PubChem CID11697052
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide
SMILESCc1ccc(C(=O)Nc2cccnc2C(=O)NOC2CCCCC2)c2ccccc12
InChIInChI=1S/C24H25N3O3/c1-16-13-14-20(19-11-6-5-10-18(16)19)23(28)26-21-12-7-15-25-22(21)24(29)27-30-17-8-3-2-4-9-17/h5-7,10-15,17H,2-4,8-9H2,1H3,(H,26,28)(H,27,29)
InChIKeyCOGOZBAVIBWSIA-UHFFFAOYSA-N
XLogP4.79
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-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-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide (CID 11697052) is N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide is Cc1ccc(C(=O)Nc2cccnc2C(=O)NOC2CCCCC2)c2ccccc12.
What is the InChIKey of N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide?
The InChIKey is COGOZBAVIBWSIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-16-13-14-20(19-11-6-5-10-18(16)19)23(28)26-21-12-7-15-25-22(21)24(29)27-30-17-8-3-2-4-9-17/h5-7,10-15,17H,2-4,8-9H2,1H3,(H,26,28)(H,27,29).
What are the key properties of N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide?
N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide has a molecular weight of 403.48 g/mol, XLogP of 4.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyloxy-3-[(4-methylnaphthalene-1-carbonyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 11697052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).