N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide

C20H24N4O2 — CID 67239550

IUPACN-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESO=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C20H24N4O2/c25-20(16-5-8-19(22-13-16)24-10-1-2-11-24)23-17-6-3-15(4-7-17)18-14-21-9-12-26-18/h3-8,13,18,21H,1-2,9-12,14H2,(H,23,25)
InChIKeyUWODRITUZJRKEG-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.60
Rot. Bonds4

About N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide

N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide (PubChem CID 67239550) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
PubChem CID67239550
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESO=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(N2CCCC2)nc1
InChIInChI=1S/C20H24N4O2/c25-20(16-5-8-19(22-13-16)24-10-1-2-11-24)23-17-6-3-15(4-7-17)18-14-21-9-12-26-18/h3-8,13,18,21H,1-2,9-12,14H2,(H,23,25)
InChIKeyUWODRITUZJRKEG-UHFFFAOYSA-N
XLogP2.60
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide (CID 67239550) is N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide is O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(N2CCCC2)nc1.
What is the InChIKey of N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide?
The InChIKey is UWODRITUZJRKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c25-20(16-5-8-19(22-13-16)24-10-1-2-11-24)23-17-6-3-15(4-7-17)18-14-21-9-12-26-18/h3-8,13,18,21H,1-2,9-12,14H2,(H,23,25).
What are the key properties of N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide?
N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-2-ylphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 67239550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).