N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide

C15H19FN2O2 — CID 110820378

IUPACN-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C15H19FN2O2/c1-2-14(19)17-13-6-8-18(9-7-13)15(20)11-4-3-5-12(16)10-11/h3-5,10,13H,2,6-9H2,1H3,(H,17,19)
InChIKeyCCVHWLHXTPBOAU-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.96
Rot. Bonds3

About N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide

N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide (PubChem CID 110820378) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
PubChem CID110820378
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC NameN-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C15H19FN2O2/c1-2-14(19)17-13-6-8-18(9-7-13)15(20)11-4-3-5-12(16)10-11/h3-5,10,13H,2,6-9H2,1H3,(H,17,19)
InChIKeyCCVHWLHXTPBOAU-UHFFFAOYSA-N
XLogP1.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]propanamide
CID 95051620
N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide
CID 110820382
N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 49348900
2-chloro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108566907
2,2-dichloro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108566898
2,2,2-trifluoro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108548760
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]propanamide
CID 110822825
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]propanamide
CID 108562134
N-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]acetamide
CID 95051606
N-[(3R)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]acetamide
CID 95051605
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110821572
1-(3-fluorobenzoyl)-N-pentan-3-ylpiperidine-4-carboxamide
CID 17223719

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide (CID 110820378) is N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1.
What is the InChIKey of N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide?
The InChIKey is CCVHWLHXTPBOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c1-2-14(19)17-13-6-8-18(9-7-13)15(20)11-4-3-5-12(16)10-11/h3-5,10,13H,2,6-9H2,1H3,(H,17,19).
What are the key properties of N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide?
N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide has a molecular weight of 278.33 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 110820378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).