3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide

C11H11FN2O — CID 129348790

IUPAC3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide
SMILESO=C(N[C@@H]1CC12CC2)c1ccncc1F
InChIInChI=1S/C11H11FN2O/c12-8-6-13-4-1-7(8)10(15)14-9-5-11(9)2-3-11/h1,4,6,9H,2-3,5H2,(H,14,15)/t9-/m1/s1
InChIKeyKTHOHXKQMXBELQ-SECBINFHSA-N
MW206.22 g/mol
LogP1.50
Rot. Bonds2

About 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide

3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide (PubChem CID 129348790) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide
PubChem CID129348790
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide
SMILESO=C(N[C@@H]1CC12CC2)c1ccncc1F
InChIInChI=1S/C11H11FN2O/c12-8-6-13-4-1-7(8)10(15)14-9-5-11(9)2-3-11/h1,4,6,9H,2-3,5H2,(H,14,15)/t9-/m1/s1
InChIKeyKTHOHXKQMXBELQ-SECBINFHSA-N
XLogP1.50
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-fluoropyridine-4-carbonyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 82760270
3-fluoro-N-(2-methylcyclopropyl)pyridine-4-carboxamide
CID 115646459
N-cyclohexyl-3-fluoropyridine-4-carboxamide
CID 64950507
N-(3-aminocyclobutyl)-3-fluoropyridine-4-carboxamide
CID 64951103
3-fluoro-N-(4-hydroxycyclohexyl)pyridine-4-carboxamide
CID 64950701
N-(4-aminocyclohexyl)-3-fluoropyridine-4-carboxamide
CID 64950869
3-fluoro-N-(2-hydroxycyclohexyl)pyridine-4-carboxamide
CID 64950714
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-fluoropyridine-4-carboxamide
CID 79711836
N-(1,1-dioxothian-4-yl)-3-fluoropyridine-4-carboxamide
CID 115646668
3-fluoro-N-piperidin-4-ylpyridine-4-carboxamide;dihydrochloride
CID 117073389
N-(2-ethylcyclohexyl)-3-fluoropyridine-4-carboxamide
CID 115645871
(3-fluoro-4-pyridinyl)-(1-methylcyclopropyl)methanone
CID 104737938

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide (CID 129348790) is 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide is O=C(N[C@@H]1CC12CC2)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide?
The InChIKey is KTHOHXKQMXBELQ-SECBINFHSA-N. The full InChI is InChI=1S/C11H11FN2O/c12-8-6-13-4-1-7(8)10(15)14-9-5-11(9)2-3-11/h1,4,6,9H,2-3,5H2,(H,14,15)/t9-/m1/s1.
What are the key properties of 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide?
3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide has a molecular weight of 206.22 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(2R)-spiro[2.2]pentan-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 129348790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).