N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide

C19H23N3O2 — CID 109182282

IUPACN-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1
InChIInChI=1S/C19H23N3O2/c1-2-24-17-10-7-15(8-11-17)21-16-9-12-18(20-13-16)19(23)22-14-5-3-4-6-14/h7-14,21H,2-6H2,1H3,(H,22,23)
InChIKeyOYJIORZCOPFGDQ-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.90
Rot. Bonds6

About N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide

N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide (PubChem CID 109182282) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
PubChem CID109182282
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1
InChIInChI=1S/C19H23N3O2/c1-2-24-17-10-7-15(8-11-17)21-16-9-12-18(20-13-16)19(23)22-14-5-3-4-6-14/h7-14,21H,2-6H2,1H3,(H,22,23)
InChIKeyOYJIORZCOPFGDQ-UHFFFAOYSA-N
XLogP3.90
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
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-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide (CID 109182282) is N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide is CCOc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1.
What is the InChIKey of N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The InChIKey is OYJIORZCOPFGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-2-24-17-10-7-15(8-11-17)21-16-9-12-18(20-13-16)19(23)22-14-5-3-4-6-14/h7-14,21H,2-6H2,1H3,(H,22,23).
What are the key properties of N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide?
N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109182282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).