6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide

C25H23F3N4O3 — CID 46205353

IUPAC6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide
SMILESO=C(NC1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C25H23F3N4O3/c26-25(27,28)17-4-1-3-16(15-17)18-7-8-21-23(30-18)19(9-12-35-21)31-24(33)20-5-2-6-22(29-20)32-10-13-34-14-11-32/h1-8,15,19H,9-14H2,(H,31,33)
InChIKeyZFLLXLQOOBZABQ-UHFFFAOYSA-N
MW484.48 g/mol
LogP4.25
Rot. Bonds4

About 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide

6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide (PubChem CID 46205353) has the molecular formula C25H23F3N4O3 and a molecular weight of 484.48 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide
PubChem CID46205353
Molecular FormulaC25H23F3N4O3
Molecular Weight484.48 g/mol
Exact Mass484.17
IUPAC Name6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide
SMILESO=C(NC1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C25H23F3N4O3/c26-25(27,28)17-4-1-3-16(15-17)18-7-8-21-23(30-18)19(9-12-35-21)31-24(33)20-5-2-6-22(29-20)32-10-13-34-14-11-32/h1-8,15,19H,9-14H2,(H,31,33)
InChIKeyZFLLXLQOOBZABQ-UHFFFAOYSA-N
XLogP4.25
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.48
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridine-4-carboxylic acid
CID 58484116
6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-ol
CID 58484062
(3-morpholin-4-ylphenyl)-[3-[6-[3-(trifluoromethyl)phenyl]-2-pyridinyl]piperidin-1-yl]methanone
CID 132773829
5-methyl-N-[2-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroquinolin-8-yl]pyrazine-2-carboxamide
CID 46205683
6-morpholin-4-ylpyridine-2-carbohydrazide
CID 67450200
N-(2,6-dimorpholin-4-yl-3-pyridinyl)-3-(trifluoromethyl)benzamide
CID 2741373
N-(2-morpholin-4-yl-4-pyridinyl)-8-[3-(trifluoromethyl)phenyl]quinoline-2-carboxamide
CID 70853123
N-(oxan-4-yl)-2-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroquinoline-8-carboxamide
CID 58484132
N-pyridin-4-yl-7-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazepine-5-carboxamide
CID 67170840
N-(2-fluorophenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573960
N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 53233230
morpholin-4-yl-(6-morpholin-4-yl-2-pyridinyl)methanone
CID 84575028

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide?
The IUPAC name of 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide (CID 46205353) is 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide is O=C(NC1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21)c1cccc(N2CCOCC2)n1.
What is the InChIKey of 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide?
The InChIKey is ZFLLXLQOOBZABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23F3N4O3/c26-25(27,28)17-4-1-3-16(15-17)18-7-8-21-23(30-18)19(9-12-35-21)31-24(33)20-5-2-6-22(29-20)32-10-13-34-14-11-32/h1-8,15,19H,9-14H2,(H,31,33).
What are the key properties of 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide?
6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide has a molecular weight of 484.48 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-[6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 46205353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).