6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide

C25H23N5O2 — CID 24788780

IUPAC6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-c2ncc(-c3ccccc3)[nH]2)c1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C25H23N5O2/c31-25(20-9-10-23(26-16-20)30-11-13-32-14-12-30)28-21-8-4-7-19(15-21)24-27-17-22(29-24)18-5-2-1-3-6-18/h1-10,15-17H,11-14H2,(H,27,29)(H,28,31)
InChIKeyQWRDDSFWTVFLDM-UHFFFAOYSA-N
MW425.49 g/mol
LogP4.23
Rot. Bonds5

About 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide

6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide (PubChem CID 24788780) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide
PubChem CID24788780
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC Name6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-c2ncc(-c3ccccc3)[nH]2)c1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C25H23N5O2/c31-25(20-9-10-23(26-16-20)30-11-13-32-14-12-30)28-21-8-4-7-19(15-21)24-27-17-22(29-24)18-5-2-1-3-6-18/h1-10,15-17H,11-14H2,(H,27,29)(H,28,31)
InChIKeyQWRDDSFWTVFLDM-UHFFFAOYSA-N
XLogP4.23
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide (CID 24788780) is 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide is O=C(Nc1cccc(-c2ncc(-c3ccccc3)[nH]2)c1)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is QWRDDSFWTVFLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c31-25(20-9-10-23(26-16-20)30-11-13-32-14-12-30)28-21-8-4-7-19(15-21)24-27-17-22(29-24)18-5-2-1-3-6-18/h1-10,15-17H,11-14H2,(H,27,29)(H,28,31).
What are the key properties of 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide?
6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 425.49 g/mol, XLogP of 4.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 24788780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).