1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide

C12H14FN3O2 — CID 146074769

IUPAC1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1nc(C(=O)N2CCCC2C(N)=O)ccc1F
InChIInChI=1S/C12H14FN3O2/c1-7-8(13)4-5-9(15-7)12(18)16-6-2-3-10(16)11(14)17/h4-5,10H,2-3,6H2,1H3,(H2,14,17)
InChIKeyKOXFVUSMHFDSDE-UHFFFAOYSA-N
MW251.26 g/mol
LogP0.62
Rot. Bonds2

About 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide

1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 146074769) has the molecular formula C12H14FN3O2 and a molecular weight of 251.26 g/mol. Its IUPAC name is 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID146074769
Molecular FormulaC12H14FN3O2
Molecular Weight251.26 g/mol
Exact Mass251.11
IUPAC Name1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1nc(C(=O)N2CCCC2C(N)=O)ccc1F
InChIInChI=1S/C12H14FN3O2/c1-7-8(13)4-5-9(15-7)12(18)16-6-2-3-10(16)11(14)17/h4-5,10H,2-3,6H2,1H3,(H2,14,17)
InChIKeyKOXFVUSMHFDSDE-UHFFFAOYSA-N
XLogP0.62
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.26
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-chloropyridine-2-carbonyl)pyrrolidine-2-carboxamide
CID 55052299
1-(2-fluoro-5-methylbenzoyl)piperidine-2-carboxamide
CID 62508896
(2R)-1-[2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]pyrrolidine-2-carboxamide
CID 39309690
1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 60659210
1-(4-fluoro-3-sulfanylbenzoyl)pyrrolidine-2-carboxamide
CID 107021942
1-(5-amino-2-methylpyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 54916812
1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63972948
(2S)-1-(4-methoxybenzoyl)pyrrolidine-2-carboxamide
CID 110867482
(2R)-1-[2-fluoro-4-(4-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide
CID 96533912
1-(2-fluoro-5-sulfanylbenzoyl)piperidine-2-carboxamide
CID 107026087
1-(2-chloro-6-methylpyridine-4-carbonyl)pyrrolidine-2-carboxamide
CID 113378308
(2S)-1-[4-(3,4,5-trifluorophenyl)benzoyl]pyrrolidine-2-carboxamide
CID 96510202

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide (CID 146074769) is 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide is Cc1nc(C(=O)N2CCCC2C(N)=O)ccc1F.
What is the InChIKey of 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is KOXFVUSMHFDSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3O2/c1-7-8(13)4-5-9(15-7)12(18)16-6-2-3-10(16)11(14)17/h4-5,10H,2-3,6H2,1H3,(H2,14,17).
What are the key properties of 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide?
1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 251.26 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-6-methylpyridine-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 146074769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).