N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide

C15H18ClFN2O2 — CID 110821572

IUPACN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)c2c(F)cccc2Cl)CC1
InChIInChI=1S/C15H18ClFN2O2/c1-2-13(20)18-10-6-8-19(9-7-10)15(21)14-11(16)4-3-5-12(14)17/h3-5,10H,2,6-9H2,1H3,(H,18,20)
InChIKeyZDDDQWQHWDFNPP-UHFFFAOYSA-N
MW312.77 g/mol
LogP2.61
Rot. Bonds3

About N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide

N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide (PubChem CID 110821572) has the molecular formula C15H18ClFN2O2 and a molecular weight of 312.77 g/mol. Its IUPAC name is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
PubChem CID110821572
Molecular FormulaC15H18ClFN2O2
Molecular Weight312.77 g/mol
Exact Mass312.10
IUPAC NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)c2c(F)cccc2Cl)CC1
InChIInChI=1S/C15H18ClFN2O2/c1-2-13(20)18-10-6-8-19(9-7-10)15(21)14-11(16)4-3-5-12(14)17/h3-5,10H,2,6-9H2,1H3,(H,18,20)
InChIKeyZDDDQWQHWDFNPP-UHFFFAOYSA-N
XLogP2.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.77
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide 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

2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108567332
2,2-dichloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108567322
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108550866
1-(2-chloro-6-fluorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 113003080
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558235
N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110820378
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
CID 108567325
1-(2-chloro-6-fluorobenzoyl)-N-(2-ethylphenyl)piperidine-4-carboxamide
CID 113006619
N-[1-(3-bromo-2-fluorobenzoyl)piperidin-4-yl]propanamide
CID 106544278
(2-chloro-6-fluorophenyl)-(3-methylpyrrolidin-1-yl)methanone
CID 110749738
(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone
CID 54923672
2-chloro-6-fluoro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108558699

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide (CID 110821572) is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)c2c(F)cccc2Cl)CC1.
What is the InChIKey of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide?
The InChIKey is ZDDDQWQHWDFNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClFN2O2/c1-2-13(20)18-10-6-8-19(9-7-10)15(21)14-11(16)4-3-5-12(14)17/h3-5,10H,2,6-9H2,1H3,(H,18,20).
What are the key properties of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide?
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide has a molecular weight of 312.77 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 110821572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).