1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide

C23H25ClN2O3 — CID 78902248

IUPAC1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide
SMILESO=C1CCc2cc(OCCNC(=O)C3(c4ccc(Cl)cc4)CCCC3)ccc2N1
InChIInChI=1S/C23H25ClN2O3/c24-18-6-4-17(5-7-18)23(11-1-2-12-23)22(28)25-13-14-29-19-8-9-20-16(15-19)3-10-21(27)26-20/h4-9,15H,1-3,10-14H2,(H,25,28)(H,26,27)
InChIKeyRQFSLUQBWRTURO-UHFFFAOYSA-N
MW412.92 g/mol
LogP4.23
Rot. Bonds6

About 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide

1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide (PubChem CID 78902248) has the molecular formula C23H25ClN2O3 and a molecular weight of 412.92 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide
PubChem CID78902248
Molecular FormulaC23H25ClN2O3
Molecular Weight412.92 g/mol
Exact Mass412.16
IUPAC Name1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide
SMILESO=C1CCc2cc(OCCNC(=O)C3(c4ccc(Cl)cc4)CCCC3)ccc2N1
InChIInChI=1S/C23H25ClN2O3/c24-18-6-4-17(5-7-18)23(11-1-2-12-23)22(28)25-13-14-29-19-8-9-20-16(15-19)3-10-21(27)26-20/h4-9,15H,1-3,10-14H2,(H,25,28)(H,26,27)
InChIKeyRQFSLUQBWRTURO-UHFFFAOYSA-N
XLogP4.23
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.92
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide 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

N-[2-(4-chlorophenoxy)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 32621862
(E)-3-(2,5-dichlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]prop-2-enamide
CID 78891903
1,4-dichlorobenzene;6-(4-sulfanylbutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 88753256
4-methoxy-N-[2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)oxy]ethyl]benzamide
CID 172880287
3,5-dichloro-4-methoxy-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]benzamide
CID 78902281
N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]-4-pentoxybenzamide
CID 78891688
3-(4-tert-butylphenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]propanamide
CID 78891707
N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]-4-(phenoxymethyl)benzamide
CID 78891643
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]butanamide
CID 55781156
6-[4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutoxy]-3,4-dihydro-1H-quinolin-2-one
CID 55970935
(E)-3-(2,3-dichlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]prop-2-enamide
CID 78891650
1-amino-N-[2-(4-chlorophenoxy)ethyl]cyclopentane-1-carboxamide
CID 119271539

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide (CID 78902248) is 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide is O=C1CCc2cc(OCCNC(=O)C3(c4ccc(Cl)cc4)CCCC3)ccc2N1.
What is the InChIKey of 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide?
The InChIKey is RQFSLUQBWRTURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN2O3/c24-18-6-4-17(5-7-18)23(11-1-2-12-23)22(28)25-13-14-29-19-8-9-20-16(15-19)3-10-21(27)26-20/h4-9,15H,1-3,10-14H2,(H,25,28)(H,26,27).
What are the key properties of 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide?
1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide has a molecular weight of 412.92 g/mol, XLogP of 4.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 78902248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).