1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

C20H21FN2O3 — CID 17019052

IUPAC1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(C(=O)c3ccccc3F)CC2)c1
InChIInChI=1S/C20H21FN2O3/c1-26-16-6-4-5-15(13-16)22-19(24)14-9-11-23(12-10-14)20(25)17-7-2-3-8-18(17)21/h2-8,13-14H,9-12H2,1H3,(H,22,24)
InChIKeyAHZPXVYIHJKHOM-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.33
Rot. Bonds4

About 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide (PubChem CID 17019052) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
PubChem CID17019052
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CCN(C(=O)c3ccccc3F)CC2)c1
InChIInChI=1S/C20H21FN2O3/c1-26-16-6-4-5-15(13-16)22-19(24)14-9-11-23(12-10-14)20(25)17-7-2-3-8-18(17)21/h2-8,13-14H,9-12H2,1H3,(H,22,24)
InChIKeyAHZPXVYIHJKHOM-UHFFFAOYSA-N
XLogP3.33
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide
CID 42881516
4-N-(2,6-difluorophenyl)-1-N-(3-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109151046
1-(3,4-dimethylbenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 113007461
N-(2,6-dimethylphenyl)-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019038
1-(2,5-difluorobenzoyl)-N-phenylpiperidine-4-carboxamide
CID 46808218
N-(3-fluorophenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 802933
1-(2-fluorobenzoyl)-N-(2-fluorophenyl)piperidine-4-carboxamide
CID 17019008
[4-(2-fluorobenzoyl)piperazin-1-yl]-(3-methoxyphenyl)methanone
CID 776701
1-(2-fluorobenzoyl)-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide
CID 17019069
1-[3-(3-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]-N-phenylpiperidine-4-carboxamide
CID 46664061
1-(4-fluorobenzoyl)-N-(3-phenoxyphenyl)piperidine-4-carboxamide
CID 9268659
N-(4-chloro-2-methylphenyl)-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 113007277

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide (CID 17019052) is 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide is COc1cccc(NC(=O)C2CCN(C(=O)c3ccccc3F)CC2)c1.
What is the InChIKey of 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
The InChIKey is AHZPXVYIHJKHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-26-16-6-4-5-15(13-16)22-19(24)14-9-11-23(12-10-14)20(25)17-7-2-3-8-18(17)21/h2-8,13-14H,9-12H2,1H3,(H,22,24).
What are the key properties of 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide?
1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide has a molecular weight of 356.40 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorobenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17019052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).