N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide

C14H20FN3O — CID 107594934

IUPACN-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)Nc1ccncc1F)C1CCCNC1
InChIInChI=1S/C14H20FN3O/c1-10(11-3-2-5-16-8-11)7-14(19)18-13-4-6-17-9-12(13)15/h4,6,9-11,16H,2-3,5,7-8H2,1H3,(H,17,18,19)
InChIKeyJZAWROLAJORKKO-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.18
Rot. Bonds4

About N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide

N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide (PubChem CID 107594934) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide
PubChem CID107594934
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC NameN-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)Nc1ccncc1F)C1CCCNC1
InChIInChI=1S/C14H20FN3O/c1-10(11-3-2-5-16-8-11)7-14(19)18-13-4-6-17-9-12(13)15/h4,6,9-11,16H,2-3,5,7-8H2,1H3,(H,17,18,19)
InChIKeyJZAWROLAJORKKO-UHFFFAOYSA-N
XLogP2.18
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-difluorophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119673275
N-(5-acetamido-2-fluorophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119705041
3-piperidin-3-yl-N-pyrimidin-5-ylbutanamide
CID 107588596
N-(2-methyl-3-pyridinyl)-3-piperidin-3-ylbutanamide
CID 81043884
N-(2-chloro-3-pyridinyl)-3-piperidin-3-ylbutanamide
CID 81044263
3-piperidin-3-yl-N-pyrimidin-2-ylbutanamide
CID 81043820
N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119709850
N-[4-fluoro-2-(4-fluorophenyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119771660
N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]-3-piperidin-3-ylbutanamide
CID 119723826
N-(3-fluoro-4-imidazol-1-ylphenyl)-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119860261
N-(3-fluorophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119671066
N-[4-fluoro-3-(methanesulfonamido)phenyl]-3-piperidin-3-ylbutanamide
CID 119702961

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide (CID 107594934) is N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide is CC(CC(=O)Nc1ccncc1F)C1CCCNC1.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide?
The InChIKey is JZAWROLAJORKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c1-10(11-3-2-5-16-8-11)7-14(19)18-13-4-6-17-9-12(13)15/h4,6,9-11,16H,2-3,5,7-8H2,1H3,(H,17,18,19).
What are the key properties of N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide?
N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide has a molecular weight of 265.33 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 107594934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).