4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide

C20H22FN3O2 — CID 24792468

IUPAC4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCC(NC(=O)c3cccc(F)c3)CC2)cc1
InChIInChI=1S/C20H22FN3O2/c1-14-5-7-17(8-6-14)23-20(26)24-11-9-18(10-12-24)22-19(25)15-3-2-4-16(21)13-15/h2-8,13,18H,9-12H2,1H3,(H,22,25)(H,23,26)
InChIKeyQYHXZAXPTLMUEX-UHFFFAOYSA-N
MW355.41 g/mol
LogP3.56
Rot. Bonds3

About 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide

4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide (PubChem CID 24792468) has the molecular formula C20H22FN3O2 and a molecular weight of 355.41 g/mol. Its IUPAC name is 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide
PubChem CID24792468
Molecular FormulaC20H22FN3O2
Molecular Weight355.41 g/mol
Exact Mass355.17
IUPAC Name4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCC(NC(=O)c3cccc(F)c3)CC2)cc1
InChIInChI=1S/C20H22FN3O2/c1-14-5-7-17(8-6-14)23-20(26)24-11-9-18(10-12-24)22-19(25)15-3-2-4-16(21)13-15/h2-8,13,18H,9-12H2,1H3,(H,22,25)(H,23,26)
InChIKeyQYHXZAXPTLMUEX-UHFFFAOYSA-N
XLogP3.56
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.41
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methoxyphenyl)-4-[(3-methylbenzoyl)amino]piperidine-1-carboxamide
CID 43814085
4-benzamido-N-(3-methylphenyl)piperidine-1-carboxamide
CID 43814049
N-(2-ethoxyphenyl)-4-[(3-fluorobenzoyl)amino]piperidine-1-carboxamide
CID 4988196
3-fluoro-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]benzamide
CID 108557444
4-[(3-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 44754288
N-benzyl-4-[(3-fluorobenzoyl)amino]piperidine-1-carboxamide
CID 24792699
4-[(3-methoxybenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 43814029
tert-butyl 4-[(3-fluorobenzoyl)amino]piperidine-1-carboxylate
CID 53255515
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-3-fluorobenzamide
CID 108557453
N-(1-ethylsulfonylpiperidin-4-yl)-3-fluorobenzamide
CID 110823002
N-[1-(4-chlorobutanoyl)piperidin-4-yl]-3-fluorobenzamide
CID 108562648
4-[2-[(3-fluorobenzoyl)amino]ethyl]-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 91903544

Frequently Asked Questions

What is the IUPAC name of 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide (CID 24792468) is 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide is Cc1ccc(NC(=O)N2CCC(NC(=O)c3cccc(F)c3)CC2)cc1.
What is the InChIKey of 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide?
The InChIKey is QYHXZAXPTLMUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O2/c1-14-5-7-17(8-6-14)23-20(26)24-11-9-18(10-12-24)22-19(25)15-3-2-4-16(21)13-15/h2-8,13,18H,9-12H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide?
4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide has a molecular weight of 355.41 g/mol, XLogP of 3.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-fluorobenzoyl)amino]-N-(4-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 24792468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).