4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide

C20H22FN3O3 — CID 43814081

IUPAC4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(NC(=O)c3ccccc3F)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)23-20(26)24-12-10-15(11-13-24)22-19(25)17-4-2-3-5-18(17)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyDMINIGYFGZPOKH-UHFFFAOYSA-N
MW371.41 g/mol
LogP3.26
Rot. Bonds4

About 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide

4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide (PubChem CID 43814081) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide
PubChem CID43814081
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC Name4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(NC(=O)c3ccccc3F)CC2)cc1
InChIInChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)23-20(26)24-12-10-15(11-13-24)22-19(25)17-4-2-3-5-18(17)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26)
InChIKeyDMINIGYFGZPOKH-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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Related Compounds

N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 3218434
4-(furan-2-carbonylamino)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 651346
N-(4-methoxyphenyl)-4-[(3-methylbenzoyl)amino]piperidine-1-carboxamide
CID 43814085
2-fluoro-N-[1-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-4-yl]benzamide
CID 75528307
4-[(5-bromo-2-fluorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 46537368
4-[(3-methoxybenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 43814029
2-fluoro-N-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]piperidin-4-yl]benzamide
CID 3221014
4-[(2-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324372
N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 43814135
4-[(2-chlorobenzoyl)amino]-N-(2-fluorophenyl)piperidine-1-carboxamide
CID 3218437
4-N-cyclohexyl-1-N-(4-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 6486998
2-[4-[(2-fluorobenzoyl)amino]piperidine-1-carbonyl]benzoic acid
CID 113083297

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide (CID 43814081) is 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCC(NC(=O)c3ccccc3F)CC2)cc1.
What is the InChIKey of 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The InChIKey is DMINIGYFGZPOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O3/c1-27-16-8-6-14(7-9-16)23-20(26)24-12-10-15(11-13-24)22-19(25)17-4-2-3-5-18(17)21/h2-9,15H,10-13H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide?
4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)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 4-[(2-fluorobenzoyl)amino]-N-(4-methoxyphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 43814081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).