N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide

C23H25FN4O2 — CID 46367999

IUPACN-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide
SMILESCCCOc1nc2ccccc2nc1N1CCC(C(=O)Nc2ccccc2F)CC1
InChIInChI=1S/C23H25FN4O2/c1-2-15-30-23-21(25-19-9-5-6-10-20(19)27-23)28-13-11-16(12-14-28)22(29)26-18-8-4-3-7-17(18)24/h3-10,16H,2,11-15H2,1H3,(H,26,29)
InChIKeyZZAJIJBZWCTQKO-UHFFFAOYSA-N
MW408.48 g/mol
LogP4.41
Rot. Bonds6

About N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide

N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide (PubChem CID 46367999) has the molecular formula C23H25FN4O2 and a molecular weight of 408.48 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide
PubChem CID46367999
Molecular FormulaC23H25FN4O2
Molecular Weight408.48 g/mol
Exact Mass408.20
IUPAC NameN-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide
SMILESCCCOc1nc2ccccc2nc1N1CCC(C(=O)Nc2ccccc2F)CC1
InChIInChI=1S/C23H25FN4O2/c1-2-15-30-23-21(25-19-9-5-6-10-20(19)27-23)28-13-11-16(12-14-28)22(29)26-18-8-4-3-7-17(18)24/h3-10,16H,2,11-15H2,1H3,(H,26,29)
InChIKeyZZAJIJBZWCTQKO-UHFFFAOYSA-N
XLogP4.41
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-ethoxyquinoxalin-2-yl)-N-(4-fluoro-2-methylphenyl)piperidine-4-carboxamide
CID 46367981
N-(2-ethylphenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752918
N-(2,5-difluorophenyl)-1-(3-methoxyquinoxalin-2-yl)piperidine-4-carboxamide
CID 46367933
N-(4-ethoxyphenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide
CID 46367968
(3S)-N-(4-chlorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 94009829
N-(4-carbamoylphenyl)-1-(3-ethoxyquinoxalin-2-yl)piperidine-4-carboxamide
CID 46367975
N-(4-acetamidophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752841
(3R)-N-(5-chloro-2-methoxyphenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 97047797
N-(5-chloro-2-methoxyphenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752840
(3R)-N-(2,4-dimethoxyphenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 94009810
N-cyclopentyl-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752908
N-[(4-fluorophenyl)methyl]-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752850

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide (CID 46367999) is N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide is CCCOc1nc2ccccc2nc1N1CCC(C(=O)Nc2ccccc2F)CC1.
What is the InChIKey of N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide?
The InChIKey is ZZAJIJBZWCTQKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN4O2/c1-2-15-30-23-21(25-19-9-5-6-10-20(19)27-23)28-13-11-16(12-14-28)22(29)26-18-8-4-3-7-17(18)24/h3-10,16H,2,11-15H2,1H3,(H,26,29).
What are the key properties of N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide?
N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide has a molecular weight of 408.48 g/mol, XLogP of 4.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1-(3-propoxyquinoxalin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 46367999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).