4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide

C16H21FN2O2 — CID 3223608

IUPAC4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C16H21FN2O2/c1-2-8-18-16(21)19-9-6-12(7-10-19)15(20)13-4-3-5-14(17)11-13/h3-5,11-12H,2,6-10H2,1H3,(H,18,21)
InChIKeyHQMMMVQTFNAPJE-UHFFFAOYSA-N
MW292.35 g/mol
LogP2.84
Rot. Bonds4

About 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide

4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide (PubChem CID 3223608) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide
PubChem CID3223608
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C16H21FN2O2/c1-2-8-18-16(21)19-9-6-12(7-10-19)15(20)13-4-3-5-14(17)11-13/h3-5,11-12H,2,6-10H2,1H3,(H,18,21)
InChIKeyHQMMMVQTFNAPJE-UHFFFAOYSA-N
XLogP2.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Melperone
CID 15387
Melperone hydrochloride
CID 9926325
N-((1-(4-(4-Fluorophenyl)-4-oxobutyl)-4-phenyl-4-piperidinyl)methyl)acetamide
CID 13122
4-(4-Fluorobenzoyl)piperidine
CID 2724440
Phenyl(piperidin-4-yl)methanone
CID 226102
p-Fluorophenyl 4-piperidyl ketone hydrochloride
CID 3084438
Buronil
CID 15386
Carperone
CID 30429
4-(4-Fluoro-benzoyl)-piperidine-1-carbothioic acid isobutyl-amide
CID 1438135
N-Cyclopentyl-2-[4-(4-methyl-benzoyl)-piperidin-1-yl]-acetamide
CID 1438298
N-[2-oxo-2-phenyl-1-(piperidin-1-yl)ethyl]acetamide
CID 3092544
4-(4-Fluoro-benzoyl)-piperidine-1-carbothioic acid propylamide
CID 3223589

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide?
The IUPAC name of 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide (CID 3223608) is 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide?
The canonical SMILES for 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide is CCCNC(=O)N1CCC(C(=O)c2cccc(F)c2)CC1.
What is the InChIKey of 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide?
The InChIKey is HQMMMVQTFNAPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c1-2-8-18-16(21)19-9-6-12(7-10-19)15(20)13-4-3-5-14(17)11-13/h3-5,11-12H,2,6-10H2,1H3,(H,18,21).
What are the key properties of 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide?
4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide has a molecular weight of 292.35 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorobenzoyl)-N-propylpiperidine-1-carboxamide is sourced from PubChem (CID 3223608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).