1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide

C26H23FN2O4 — CID 26413483

IUPAC1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide
SMILESCOc1cc2c(cc1NC(=O)C1CCN(C(=O)c3ccc(F)cc3)CC1)oc1ccccc12
InChIInChI=1S/C26H23FN2O4/c1-32-24-14-20-19-4-2-3-5-22(19)33-23(20)15-21(24)28-25(30)16-10-12-29(13-11-16)26(31)17-6-8-18(27)9-7-17/h2-9,14-16H,10-13H2,1H3,(H,28,30)
InChIKeyCDAGLCJEKAEIEI-UHFFFAOYSA-N
MW446.48 g/mol
LogP5.22
Rot. Bonds4

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

1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide (PubChem CID 26413483) has the molecular formula C26H23FN2O4 and a molecular weight of 446.48 g/mol. Its IUPAC name is 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide
PubChem CID26413483
Molecular FormulaC26H23FN2O4
Molecular Weight446.48 g/mol
Exact Mass446.16
IUPAC Name1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide
SMILESCOc1cc2c(cc1NC(=O)C1CCN(C(=O)c3ccc(F)cc3)CC1)oc1ccccc12
InChIInChI=1S/C26H23FN2O4/c1-32-24-14-20-19-4-2-3-5-22(19)33-23(20)15-21(24)28-25(30)16-10-12-29(13-11-16)26(31)17-6-8-18(27)9-7-17/h2-9,14-16H,10-13H2,1H3,(H,28,30)
InChIKeyCDAGLCJEKAEIEI-UHFFFAOYSA-N
XLogP5.22
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.48
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 1-(4-fluorobenzoyl)piperidine-4-carboxylate
CID 4833196
2,2,2-trifluoroethyl 4-[(2-methoxydibenzofuran-3-yl)carbamoyl]piperidine-1-carboxylate
CID 46680459
N-(2-methoxydibenzofuran-3-yl)-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 46404064
(3S)-1-(4-chlorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-3-carboxamide
CID 2111778
1-(2-fluorophenyl)sulfonyl-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide
CID 26413454
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 35106489
N-(2-methoxydibenzofuran-3-yl)-7-methyl-1-oxo-1,4-thiazepane-4-carboxamide
CID 119037539
1-(4-fluorobenzoyl)-N-[2-(methylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 51218219
1-(4-chlorobenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 2295609
(2S)-N-(2-methoxydibenzofuran-3-yl)pyrrolidine-2-carboxamide
CID 25166096
N-(2-methoxydibenzofuran-3-yl)pyrrolidine-2-carboxamide
CID 68603513
2-[[1-(4-fluorobenzoyl)piperidine-4-carbonyl]amino]-3,4,5-trimethoxybenzoic acid
CID 17494724

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide (CID 26413483) is 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide is COc1cc2c(cc1NC(=O)C1CCN(C(=O)c3ccc(F)cc3)CC1)oc1ccccc12.
What is the InChIKey of 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide?
The InChIKey is CDAGLCJEKAEIEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23FN2O4/c1-32-24-14-20-19-4-2-3-5-22(19)33-23(20)15-21(24)28-25(30)16-10-12-29(13-11-16)26(31)17-6-8-18(27)9-7-17/h2-9,14-16H,10-13H2,1H3,(H,28,30).
What are the key properties of 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide?
1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide has a molecular weight of 446.48 g/mol, XLogP of 5.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorobenzoyl)-N-(2-methoxydibenzofuran-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 26413483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).