N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide

C20H24N4O3 — CID 24676967

IUPACN-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)c1cccnc1
InChIInChI=1S/C20H24N4O3/c25-20(16-2-1-5-21-15-16)22-18-4-3-17(23-6-10-26-11-7-23)14-19(18)24-8-12-27-13-9-24/h1-5,14-15H,6-13H2,(H,22,25)
InChIKeyJFUHNEZBTVCSNV-UHFFFAOYSA-N
MW368.44 g/mol
LogP2.01
Rot. Bonds4

About N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide

N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide (PubChem CID 24676967) has the molecular formula C20H24N4O3 and a molecular weight of 368.44 g/mol. Its IUPAC name is N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
PubChem CID24676967
Molecular FormulaC20H24N4O3
Molecular Weight368.44 g/mol
Exact Mass368.18
IUPAC NameN-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)c1cccnc1
InChIInChI=1S/C20H24N4O3/c25-20(16-2-1-5-21-15-16)22-18-4-3-17(23-6-10-26-11-7-23)14-19(18)24-8-12-27-13-9-24/h1-5,14-15H,6-13H2,(H,22,25)
InChIKeyJFUHNEZBTVCSNV-UHFFFAOYSA-N
XLogP2.01
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide (CID 24676967) is N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide is O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)c1cccnc1.
What is the InChIKey of N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide?
The InChIKey is JFUHNEZBTVCSNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O3/c25-20(16-2-1-5-21-15-16)22-18-4-3-17(23-6-10-26-11-7-23)14-19(18)24-8-12-27-13-9-24/h1-5,14-15H,6-13H2,(H,22,25).
What are the key properties of N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide?
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 24676967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).