N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide

C19H18F2N2O3 — CID 60581444

IUPACN-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCCc3cccc(OC(F)F)c32)cc1
InChIInChI=1S/C19H18F2N2O3/c1-12(24)22-15-9-7-14(8-10-15)18(25)23-11-3-5-13-4-2-6-16(17(13)23)26-19(20)21/h2,4,6-10,19H,3,5,11H2,1H3,(H,22,24)
InChIKeyVJFOJDRYBAGGFN-UHFFFAOYSA-N
MW360.36 g/mol
LogP3.84
Rot. Bonds4

About N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide

N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide (PubChem CID 60581444) has the molecular formula C19H18F2N2O3 and a molecular weight of 360.36 g/mol. Its IUPAC name is N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide
PubChem CID60581444
Molecular FormulaC19H18F2N2O3
Molecular Weight360.36 g/mol
Exact Mass360.13
IUPAC NameN-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCCc3cccc(OC(F)F)c32)cc1
InChIInChI=1S/C19H18F2N2O3/c1-12(24)22-15-9-7-14(8-10-15)18(25)23-11-3-5-13-4-2-6-16(17(13)23)26-19(20)21/h2,4,6-10,19H,3,5,11H2,1H3,(H,22,24)
InChIKeyVJFOJDRYBAGGFN-UHFFFAOYSA-N
XLogP3.84
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide 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

(6-chloro-3-pyridinyl)-[8-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 60581548
(4-aminophenyl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 60951513
(3,4-dimethoxyphenyl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 17234056
[8-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]-[3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]methanone
CID 60581739
1-[8-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]-3-(2-methylpyrazol-3-yl)propan-1-one
CID 86798226
[8-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]-[1-[(3-methyloxetan-3-yl)methyl]triazol-4-yl]methanone
CID 126780966
N-[2-[[1-(3,4,5-trimethoxybenzoyl)-3,4-dihydro-2H-quinolin-8-yl]oxy]ethyl]acetamide
CID 16764481
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-phenylmethanone
CID 15267724
(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(3-fluoro-4-methoxyphenyl)methanone
CID 78843598
3-bromo-N-[3-(8-methoxy-3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide
CID 112832703
2-[4-[(E)-3-[8-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetonitrile
CID 60581774
N-(4-acetamidophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049557

Frequently Asked Questions

What is the IUPAC name of N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide?
The IUPAC name of N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide (CID 60581444) is N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide?
The canonical SMILES for N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide is CC(=O)Nc1ccc(C(=O)N2CCCc3cccc(OC(F)F)c32)cc1.
What is the InChIKey of N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide?
The InChIKey is VJFOJDRYBAGGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2O3/c1-12(24)22-15-9-7-14(8-10-15)18(25)23-11-3-5-13-4-2-6-16(17(13)23)26-19(20)21/h2,4,6-10,19H,3,5,11H2,1H3,(H,22,24).
What are the key properties of N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide?
N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide has a molecular weight of 360.36 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[8-(difluoromethoxy)-3,4-dihydro-2H-quinoline-1-carbonyl]phenyl]acetamide is sourced from PubChem (CID 60581444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).