N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide

C20H20F2N2O2 — CID 24682332

IUPACN-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide
SMILESCC(C(=O)Nc1cc(F)ccc1F)N1CC=C(c2ccc(O)cc2)CC1
InChIInChI=1S/C20H20F2N2O2/c1-13(20(26)23-19-12-16(21)4-7-18(19)22)24-10-8-15(9-11-24)14-2-5-17(25)6-3-14/h2-8,12-13,25H,9-11H2,1H3,(H,23,26)
InChIKeyLJSPOGDSAHBBKH-UHFFFAOYSA-N
MW358.39 g/mol
LogP3.79
Rot. Bonds4

About N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide

N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide (PubChem CID 24682332) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide
PubChem CID24682332
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC NameN-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide
SMILESCC(C(=O)Nc1cc(F)ccc1F)N1CC=C(c2ccc(O)cc2)CC1
InChIInChI=1S/C20H20F2N2O2/c1-13(20(26)23-19-12-16(21)4-7-18(19)22)24-10-8-15(9-11-24)14-2-5-17(25)6-3-14/h2-8,12-13,25H,9-11H2,1H3,(H,23,26)
InChIKeyLJSPOGDSAHBBKH-UHFFFAOYSA-N
XLogP3.79
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]-N-(2,3,4-trifluorophenyl)propanamide
CID 18125111
(2S)-N-(2,4-difluorophenyl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propanamide
CID 9495119
N-(2,4-dimethylphenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide
CID 51282418
N-(2-chloro-4-nitrophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide
CID 55470406
N-(2,5-difluorophenyl)-2-(3-methylpiperidin-1-yl)propanamide
CID 46630906
1-[1-(2,5-difluoroanilino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylic acid
CID 119905072
N-(2,5-difluorophenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide
CID 46630533
N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide
CID 86984158
1-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 67948856
(2R)-2-[4-(2-chlorophenyl)piperazin-1-yl]-N-(2,5-difluorophenyl)propanamide
CID 9444969
(2S)-2-[4-(2-chlorophenyl)piperazin-1-yl]-N-(2,5-difluorophenyl)propanamide
CID 9444967
(2R)-N-(2-cyanophenyl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propanamide
CID 8513088

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide (CID 24682332) is N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide is CC(C(=O)Nc1cc(F)ccc1F)N1CC=C(c2ccc(O)cc2)CC1.
What is the InChIKey of N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide?
The InChIKey is LJSPOGDSAHBBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c1-13(20(26)23-19-12-16(21)4-7-18(19)22)24-10-8-15(9-11-24)14-2-5-17(25)6-3-14/h2-8,12-13,25H,9-11H2,1H3,(H,23,26).
What are the key properties of N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide?
N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide has a molecular weight of 358.39 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propanamide is sourced from PubChem (CID 24682332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).