N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide

C25H29FN2O4 — CID 2379333

IUPACN,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide
SMILESO=C(c1cc(C(=O)NC2CCCCC2)c(=O)n(C2CCCCC2)c1)c1cc(F)ccc1O
InChIInChI=1S/C25H29FN2O4/c26-17-11-12-22(29)20(14-17)23(30)16-13-21(24(31)27-18-7-3-1-4-8-18)25(32)28(15-16)19-9-5-2-6-10-19/h11-15,18-19,29H,1-10H2,(H,27,31)
InChIKeyOVYBXPSOMDVRKP-UHFFFAOYSA-N
MW440.52 g/mol
LogP4.49
Rot. Bonds5

About N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide

N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide (PubChem CID 2379333) has the molecular formula C25H29FN2O4 and a molecular weight of 440.52 g/mol. Its IUPAC name is N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide
PubChem CID2379333
Molecular FormulaC25H29FN2O4
Molecular Weight440.52 g/mol
Exact Mass440.21
IUPAC NameN,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide
SMILESO=C(c1cc(C(=O)NC2CCCCC2)c(=O)n(C2CCCCC2)c1)c1cc(F)ccc1O
InChIInChI=1S/C25H29FN2O4/c26-17-11-12-22(29)20(14-17)23(30)16-13-21(24(31)27-18-7-3-1-4-8-18)25(32)28(15-16)19-9-5-2-6-10-19/h11-15,18-19,29H,1-10H2,(H,27,31)
InChIKeyOVYBXPSOMDVRKP-UHFFFAOYSA-N
XLogP4.49
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.52
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide (CID 2379333) is N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide is O=C(c1cc(C(=O)NC2CCCCC2)c(=O)n(C2CCCCC2)c1)c1cc(F)ccc1O.
What is the InChIKey of N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide?
The InChIKey is OVYBXPSOMDVRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29FN2O4/c26-17-11-12-22(29)20(14-17)23(30)16-13-21(24(31)27-18-7-3-1-4-8-18)25(32)28(15-16)19-9-5-2-6-10-19/h11-15,18-19,29H,1-10H2,(H,27,31).
What are the key properties of N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide?
N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide has a molecular weight of 440.52 g/mol, XLogP of 4.49, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dicyclohexyl-5-(5-fluoro-2-hydroxybenzoyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 2379333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).