N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

C20H22FN3O3 — CID 24792387

IUPACN-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-18-8-2-14(3-9-18)19(25)22-17-10-12-24(13-11-17)20(26)23-16-6-4-15(21)5-7-16/h2-9,17H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyCBWBODIVWMXORZ-UHFFFAOYSA-N
MW371.41 g/mol
LogP3.26
Rot. Bonds4

About N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (PubChem CID 24792387) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
PubChem CID24792387
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC NameN-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-18-8-2-14(3-9-18)19(25)22-17-10-12-24(13-11-17)20(26)23-16-6-4-15(21)5-7-16/h2-9,17H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyCBWBODIVWMXORZ-UHFFFAOYSA-N
XLogP3.26
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.41
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (CID 24792387) is N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is COc1ccc(C(=O)NC2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The InChIKey is CBWBODIVWMXORZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O3/c1-27-18-8-2-14(3-9-18)19(25)22-17-10-12-24(13-11-17)20(26)23-16-6-4-15(21)5-7-16/h2-9,17H,10-13H2,1H3,(H,22,25)(H,23,26).
What are the key properties of N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide has a molecular weight of 371.41 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 24792387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).