N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide

C11H14FN3O — CID 104954698

IUPACN-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide
SMILESO=C(CC1CCNC1)Nc1ccc(F)nc1
InChIInChI=1S/C11H14FN3O/c12-10-2-1-9(7-14-10)15-11(16)5-8-3-4-13-6-8/h1-2,7-8,13H,3-6H2,(H,15,16)
InChIKeyDHYSUUOWRYHRFS-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.16
Rot. Bonds3

About N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide

N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide (PubChem CID 104954698) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound NameN-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide
PubChem CID104954698
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC NameN-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide
SMILESO=C(CC1CCNC1)Nc1ccc(F)nc1
InChIInChI=1S/C11H14FN3O/c12-10-2-1-9(7-14-10)15-11(16)5-8-3-4-13-6-8/h1-2,7-8,13H,3-6H2,(H,15,16)
InChIKeyDHYSUUOWRYHRFS-UHFFFAOYSA-N
XLogP1.16
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-pyrimidin-5-yl-2-pyrrolidin-3-ylacetamide
CID 107588558
N-(3-bromo-4-fluorophenyl)-2-pyrrolidin-3-ylacetamide
CID 113452141
N-(1H-pyrazol-4-yl)-2-[(3S)-pyrrolidin-3-yl]acetamide
CID 130748030
N-(5-bromo-6-chloro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide
CID 114050443
N-(4-propan-2-ylphenyl)-2-pyrrolidin-3-ylacetamide
CID 58770019
N-(1H-pyrazol-4-yl)-2-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
CID 130748029
N-(3H-benzimidazol-5-yl)-2-pyrrolidin-3-ylacetamide
CID 115160286
N-[6-(diethylamino)-3-pyridinyl]-2-piperidin-3-ylacetamide
CID 62674526
N-(6-fluoro-3-pyridinyl)morpholine-2-carboxamide
CID 103808720
2-amino-N-(6-fluoro-3-pyridinyl)acetamide
CID 103794912
N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide
CID 119697450
2-pyrrolidin-3-yl-N-(2,3,5,6-tetrafluorophenyl)acetamide
CID 107641614

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide?
The IUPAC name of N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide (CID 104954698) is N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide is O=C(CC1CCNC1)Nc1ccc(F)nc1.
What is the InChIKey of N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide?
The InChIKey is DHYSUUOWRYHRFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O/c12-10-2-1-9(7-14-10)15-11(16)5-8-3-4-13-6-8/h1-2,7-8,13H,3-6H2,(H,15,16).
What are the key properties of N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide?
N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide has a molecular weight of 223.25 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 104954698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).