4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide

C16H22FN3O2 — CID 119282477

IUPAC4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide
SMILESNCCCC(=O)NC1CCN(C(=O)c2ccccc2F)CC1
InChIInChI=1S/C16H22FN3O2/c17-14-5-2-1-4-13(14)16(22)20-10-7-12(8-11-20)19-15(21)6-3-9-18/h1-2,4-5,12H,3,6-11,18H2,(H,19,21)
InChIKeyYTMPJUCFFGOKKY-UHFFFAOYSA-N
MW307.37 g/mol
LogP1.29
Rot. Bonds5

About 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide

4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide (PubChem CID 119282477) has the molecular formula C16H22FN3O2 and a molecular weight of 307.37 g/mol. Its IUPAC name is 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide.

Molecular Properties

Compound Name4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide
PubChem CID119282477
Molecular FormulaC16H22FN3O2
Molecular Weight307.37 g/mol
Exact Mass307.17
IUPAC Name4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide
SMILESNCCCC(=O)NC1CCN(C(=O)c2ccccc2F)CC1
InChIInChI=1S/C16H22FN3O2/c17-14-5-2-1-4-13(14)16(22)20-10-7-12(8-11-20)19-15(21)6-3-9-18/h1-2,4-5,12H,3,6-11,18H2,(H,19,21)
InChIKeyYTMPJUCFFGOKKY-UHFFFAOYSA-N
XLogP1.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]heptanamide
CID 119710944
3-chloro-N-[1-(2-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108563637
3-(4-chlorophenyl)-N-[1-(2-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108556555
N-[1-(2-fluorobenzoyl)piperidin-4-yl]-3-(oxan-4-yl)propanamide
CID 127366432
N-[1-(2-fluorobenzoyl)piperidin-4-yl]-3-(2-methylpropoxy)propanamide
CID 47056458
2-bromo-5-fluoro-N-[3-[[1-(2-fluorobenzoyl)piperidin-4-yl]amino]-3-oxopropyl]benzamide
CID 55839305
N-cyclopropyl-2-[4-(2-fluorobenzoyl)piperazin-1-yl]acetamide
CID 51221138
2-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]benzamide
CID 119944331
4-(2,3-dihydro-1H-inden-5-yl)-N-[1-(2-fluorobenzoyl)piperidin-4-yl]-4-oxobutanamide
CID 55710907
N-[1-(2-methylbenzoyl)piperidin-4-yl]pentanamide
CID 110820234
N-[1-(2-fluorobenzoyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108553997
4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]benzamide;hydrochloride
CID 119710955

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide?
The IUPAC name of 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide (CID 119282477) is 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide.
What is the SMILES notation for 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide?
The canonical SMILES for 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide is NCCCC(=O)NC1CCN(C(=O)c2ccccc2F)CC1.
What is the InChIKey of 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide?
The InChIKey is YTMPJUCFFGOKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FN3O2/c17-14-5-2-1-4-13(14)16(22)20-10-7-12(8-11-20)19-15(21)6-3-9-18/h1-2,4-5,12H,3,6-11,18H2,(H,19,21).
What are the key properties of 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide?
4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide has a molecular weight of 307.37 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]butanamide is sourced from PubChem (CID 119282477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).