7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide

C23H24FN3O2 — CID 46569951

IUPAC7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide
SMILESCc1nc2cc(F)ccc2cc1C(=O)NCC(c1ccccc1)N1CCOCC1
InChIInChI=1S/C23H24FN3O2/c1-16-20(13-18-7-8-19(24)14-21(18)26-16)23(28)25-15-22(17-5-3-2-4-6-17)27-9-11-29-12-10-27/h2-8,13-14,22H,9-12,15H2,1H3,(H,25,28)
InChIKeyRJLDMGMNKBNZFI-UHFFFAOYSA-N
MW393.46 g/mol
LogP3.49
Rot. Bonds5

About 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide

7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide (PubChem CID 46569951) has the molecular formula C23H24FN3O2 and a molecular weight of 393.46 g/mol. Its IUPAC name is 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide.

Molecular Properties

Compound Name7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide
PubChem CID46569951
Molecular FormulaC23H24FN3O2
Molecular Weight393.46 g/mol
Exact Mass393.19
IUPAC Name7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide
SMILESCc1nc2cc(F)ccc2cc1C(=O)NCC(c1ccccc1)N1CCOCC1
InChIInChI=1S/C23H24FN3O2/c1-16-20(13-18-7-8-19(24)14-21(18)26-16)23(28)25-15-22(17-5-3-2-4-6-17)27-9-11-29-12-10-27/h2-8,13-14,22H,9-12,15H2,1H3,(H,25,28)
InChIKeyRJLDMGMNKBNZFI-UHFFFAOYSA-N
XLogP3.49
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.46
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-5-methyl-1-phenylpyrazole-4-carboxamide
CID 17467172
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylsulfanylbenzamide
CID 2460009
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2,3-dimethylbenzamide
CID 30878247
2-fluoro-N-(2-morpholin-4-yl-2-phenylethyl)pyridine-3-carboxamide
CID 91197833
2-fluoro-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460592
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]quinoline-6-carboxamide
CID 4249333
5-chloro-2-fluoro-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]benzamide
CID 17460307
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide
CID 55535821
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]benzamide
CID 55331734
1-[(4-fluorophenyl)methyl]-3-(2-morpholin-4-yl-2-phenylethyl)urea
CID 42890407
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-1-methylindole-3-carboxamide
CID 29223882
4-methyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]thiadiazole-5-carboxamide
CID 39730184

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide?
The IUPAC name of 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide (CID 46569951) is 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide.
What is the SMILES notation for 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide?
The canonical SMILES for 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide is Cc1nc2cc(F)ccc2cc1C(=O)NCC(c1ccccc1)N1CCOCC1.
What is the InChIKey of 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide?
The InChIKey is RJLDMGMNKBNZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O2/c1-16-20(13-18-7-8-19(24)14-21(18)26-16)23(28)25-15-22(17-5-3-2-4-6-17)27-9-11-29-12-10-27/h2-8,13-14,22H,9-12,15H2,1H3,(H,25,28).
What are the key properties of 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide?
7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide has a molecular weight of 393.46 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide is sourced from PubChem (CID 46569951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).