1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

C24H27FN2O3 — CID 55671092

IUPAC1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1
InChIInChI=1S/C24H27FN2O3/c1-30-21-6-3-2-5-20(21)26-22(28)17-11-15-27(16-12-17)23(29)24(13-4-14-24)18-7-9-19(25)10-8-18/h2-3,5-10,17H,4,11-16H2,1H3,(H,26,28)
InChIKeyRKERGOXVGOMGLT-UHFFFAOYSA-N
MW410.49 g/mol
LogP4.13
Rot. Bonds5

About 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide (PubChem CID 55671092) has the molecular formula C24H27FN2O3 and a molecular weight of 410.49 g/mol. Its IUPAC name is 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
PubChem CID55671092
Molecular FormulaC24H27FN2O3
Molecular Weight410.49 g/mol
Exact Mass410.20
IUPAC Name1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1
InChIInChI=1S/C24H27FN2O3/c1-30-21-6-3-2-5-20(21)26-22(28)17-11-15-27(16-12-17)23(29)24(13-4-14-24)18-7-9-19(25)10-8-18/h2-3,5-10,17H,4,11-16H2,1H3,(H,26,28)
InChIKeyRKERGOXVGOMGLT-UHFFFAOYSA-N
XLogP4.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.49
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496
1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55810106
1-(2,2-dimethylpropanoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17224335
1-[(4-fluorophenyl)methyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 45007705
1-[2-(4-fluoroanilino)-2-oxoethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 16909483
1-(2-fluorophenyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17152653
1-[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
CID 119732606
1-N,1-N-diethyl-4-N-(2-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 56922674
1-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 37187519
3-[4-[(2-methoxyphenyl)carbamoyl]piperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120549472
N-(2-methoxyphenyl)-1-[2-(trifluoromethylsulfanyl)acetyl]piperidine-4-carboxamide
CID 38644491
N-(2-methoxyphenyl)-4-(4-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146305

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide (CID 55671092) is 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide is COc1ccccc1NC(=O)C1CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1.
What is the InChIKey of 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The InChIKey is RKERGOXVGOMGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN2O3/c1-30-21-6-3-2-5-20(21)26-22(28)17-11-15-27(16-12-17)23(29)24(13-4-14-24)18-7-9-19(25)10-8-18/h2-3,5-10,17H,4,11-16H2,1H3,(H,26,28).
What are the key properties of 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide has a molecular weight of 410.49 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-fluorophenyl)cyclobutanecarbonyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 55671092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).