N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

C20H22FN3O3 — CID 3218434

IUPACN-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)19(25)22-15-10-12-24(13-11-15)20(26)23-18-5-3-2-4-17(18)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyANSOPABQRJZWJS-UHFFFAOYSA-N
MW371.41 g/mol
LogP3.26
Rot. Bonds4

About N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (PubChem CID 3218434) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
PubChem CID3218434
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC NameN-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)19(25)22-15-10-12-24(13-11-15)20(26)23-18-5-3-2-4-17(18)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyANSOPABQRJZWJS-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-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (CID 3218434) is N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is COc1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3F)CC2)cc1.
What is the InChIKey of N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The InChIKey is ANSOPABQRJZWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)19(25)22-15-10-12-24(13-11-15)20(26)23-18-5-3-2-4-17(18)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26).
What are the key properties of N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
N-(2-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-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 3218434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).