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

C17H23FN2O2 — CID 110820382

IUPACN-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C17H23FN2O2/c1-2-3-7-16(21)19-15-8-10-20(11-9-15)17(22)13-5-4-6-14(18)12-13/h4-6,12,15H,2-3,7-11H2,1H3,(H,19,21)
InChIKeyDENWCTXRODVIOK-UHFFFAOYSA-N
MW306.38 g/mol
LogP2.74
Rot. Bonds5

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

N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide (PubChem CID 110820382) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide.

Molecular Properties

Compound NameN-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide
PubChem CID110820382
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC NameN-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C17H23FN2O2/c1-2-3-7-16(21)19-15-8-10-20(11-9-15)17(22)13-5-4-6-14(18)12-13/h4-6,12,15H,2-3,7-11H2,1H3,(H,19,21)
InChIKeyDENWCTXRODVIOK-UHFFFAOYSA-N
XLogP2.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110820378
N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 49348900
N-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]propanamide
CID 95051620
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-methylbenzoyl)piperidin-4-yl]pentanamide
CID 110820234
N-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]acetamide
CID 95051606
N-[(3R)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]acetamide
CID 95051605
[3-[4-(4-chlorobutanoylamino)piperidine-1-carbonyl]phenyl] acetate
CID 108563337
1-[(3R)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]-3-methylurea
CID 95051713
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108549659

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide?
The IUPAC name of N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide (CID 110820382) is N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide.
What is the SMILES notation for N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide?
The canonical SMILES for N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide is CCCCC(=O)NC1CCN(C(=O)c2cccc(F)c2)CC1.
What is the InChIKey of N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide?
The InChIKey is DENWCTXRODVIOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c1-2-3-7-16(21)19-15-8-10-20(11-9-15)17(22)13-5-4-6-14(18)12-13/h4-6,12,15H,2-3,7-11H2,1H3,(H,19,21).
What are the key properties of N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide?
N-[1-(3-fluorobenzoyl)piperidin-4-yl]pentanamide has a molecular weight of 306.38 g/mol, XLogP of 2.74, 5 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]pentanamide is sourced from PubChem (CID 110820382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).