N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide

C19H23N3O2 — CID 648229

IUPACN-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C19H23N3O2/c1-24-17-10-6-5-9-16(17)22-18-12-11-14(13-20-18)19(23)21-15-7-3-2-4-8-15/h5-6,9-13,15H,2-4,7-8H2,1H3,(H,20,22)(H,21,23)
InChIKeyAZSCCUYSCQAZFI-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.90
Rot. Bonds5

About N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide

N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide (PubChem CID 648229) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide
PubChem CID648229
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C19H23N3O2/c1-24-17-10-6-5-9-16(17)22-18-12-11-14(13-20-18)19(23)21-15-7-3-2-4-8-15/h5-6,9-13,15H,2-4,7-8H2,1H3,(H,20,22)(H,21,23)
InChIKeyAZSCCUYSCQAZFI-UHFFFAOYSA-N
XLogP3.90
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide (CID 648229) is N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide is COc1ccccc1Nc1ccc(C(=O)NC2CCCCC2)cn1.
What is the InChIKey of N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide?
The InChIKey is AZSCCUYSCQAZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-24-17-10-6-5-9-16(17)22-18-12-11-14(13-20-18)19(23)21-15-7-3-2-4-8-15/h5-6,9-13,15H,2-4,7-8H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide?
N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 648229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).