(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone

C18H15F2NO — CID 176579757

IUPAC(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(c1c(F)cc(-c2ccccc2)cc1F)N1CC=CCC1
InChIInChI=1S/C18H15F2NO/c19-15-11-14(13-7-3-1-4-8-13)12-16(20)17(15)18(22)21-9-5-2-6-10-21/h1-5,7-8,11-12H,6,9-10H2
InChIKeyHSVZATHIJLGKSI-UHFFFAOYSA-N
MW299.32 g/mol
LogP4.03
Rot. Bonds2

About (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone

(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 176579757) has the molecular formula C18H15F2NO and a molecular weight of 299.32 g/mol. Its IUPAC name is (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID176579757
Molecular FormulaC18H15F2NO
Molecular Weight299.32 g/mol
Exact Mass299.11
IUPAC Name(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(c1c(F)cc(-c2ccccc2)cc1F)N1CC=CCC1
InChIInChI=1S/C18H15F2NO/c19-15-11-14(13-7-3-1-4-8-13)12-16(20)17(15)18(22)21-9-5-2-6-10-21/h1-5,7-8,11-12H,6,9-10H2
InChIKeyHSVZATHIJLGKSI-UHFFFAOYSA-N
XLogP4.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,6-dihydro-2H-pyridin-1-yl-(3-fluorophenyl)methanone
CID 141178396
3-(3,6-dihydro-2H-pyridine-1-carbonyl)benzoic acid
CID 114412273
(4-amino-3-fluorophenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 114407102
2-(3,6-dihydro-2H-pyridine-1-carbonyl)benzenesulfonamide
CID 114412238
3,6-dihydro-2H-pyridin-1-yl-(2-iodophenyl)methanone
CID 10881534
(3-chlorophenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 141178418
3,6-dihydro-2H-pyridin-1-yl-(2-sulfanylphenyl)methanone
CID 107036222
3,6-dihydro-2H-pyridin-1-yl-[2-fluoro-5-(trifluoromethyl)phenyl]methanone
CID 115970002
4-(3,6-dihydro-2H-pyridine-1-carbonyl)pyridine-2-carboxylic acid
CID 114412276
3-[1-(2,6-difluoro-4-phenylbenzoyl)-3-(methylamino)azetidin-3-yl]propanal
CID 137468536
(4-chloroquinolin-2-yl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 114408574
(6-bromonaphthalen-2-yl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 115969934

Frequently Asked Questions

What is the IUPAC name of (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone (CID 176579757) is (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone is O=C(c1c(F)cc(-c2ccccc2)cc1F)N1CC=CCC1.
What is the InChIKey of (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is HSVZATHIJLGKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2NO/c19-15-11-14(13-7-3-1-4-8-13)12-16(20)17(15)18(22)21-9-5-2-6-10-21/h1-5,7-8,11-12H,6,9-10H2.
What are the key properties of (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone?
(2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 299.32 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluoro-4-phenylphenyl)-(3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 176579757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).