4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide

C25H27FN4O3 — CID 165112983

IUPAC4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide
SMILESO=C(NC1CCC(Oc2nc(N3CCOCC3)cc3ncccc23)CC1)c1ccc(F)cc1
InChIInChI=1S/C25H27FN4O3/c26-18-5-3-17(4-6-18)24(31)28-19-7-9-20(10-8-19)33-25-21-2-1-11-27-22(21)16-23(29-25)30-12-14-32-15-13-30/h1-6,11,16,19-20H,7-10,12-15H2,(H,28,31)
InChIKeyNOSKDJHIYNTGKD-UHFFFAOYSA-N
MW450.51 g/mol
LogP3.73
Rot. Bonds5

About 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide

4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide (PubChem CID 165112983) has the molecular formula C25H27FN4O3 and a molecular weight of 450.51 g/mol. Its IUPAC name is 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide
PubChem CID165112983
Molecular FormulaC25H27FN4O3
Molecular Weight450.51 g/mol
Exact Mass450.21
IUPAC Name4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide
SMILESO=C(NC1CCC(Oc2nc(N3CCOCC3)cc3ncccc23)CC1)c1ccc(F)cc1
InChIInChI=1S/C25H27FN4O3/c26-18-5-3-17(4-6-18)24(31)28-19-7-9-20(10-8-19)33-25-21-2-1-11-27-22(21)16-23(29-25)30-12-14-32-15-13-30/h1-6,11,16,19-20H,7-10,12-15H2,(H,28,31)
InChIKeyNOSKDJHIYNTGKD-UHFFFAOYSA-N
XLogP3.73
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.51
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyridine-3-carboxamide
CID 165112973
5-chloro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyrimidine-2-carboxamide
CID 165112805
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyridazin-3-amine
CID 165113093
5-iodo-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyrimidin-2-amine
CID 165113010
1-[2-[[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]amino]pyrimidin-4-yl]oxypropan-2-one
CID 175633431
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]-5-propoxypyrimidin-2-amine
CID 165113223
4-[5-[4-[4-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexyl]oxy-1,6-naphthyridin-7-yl]morpholine
CID 165112977
N-[4-(5-chloropyrimidin-2-yl)oxycyclohexyl]-4-morpholin-4-ylbenzamide
CID 90633915
N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-4-fluorobenzamide
CID 91626145
N-(4-pyrimidin-2-yloxycyclohexyl)naphthalene-2-carboxamide
CID 90633284
N-cycloheptyl-4-(3-morpholin-4-ylpyrazin-2-yl)oxybenzamide
CID 53335650
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 86281319

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide?
The IUPAC name of 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide (CID 165112983) is 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide?
The canonical SMILES for 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide is O=C(NC1CCC(Oc2nc(N3CCOCC3)cc3ncccc23)CC1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide?
The InChIKey is NOSKDJHIYNTGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27FN4O3/c26-18-5-3-17(4-6-18)24(31)28-19-7-9-20(10-8-19)33-25-21-2-1-11-27-22(21)16-23(29-25)30-12-14-32-15-13-30/h1-6,11,16,19-20H,7-10,12-15H2,(H,28,31).
What are the key properties of 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide?
4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide has a molecular weight of 450.51 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]benzamide is sourced from PubChem (CID 165112983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).