(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide

C14H15FN4O2 — CID 120965369

IUPAC(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1ccn2cc(C(=O)N3C[C@H](F)C[C@H]3C(N)=O)nc2c1
InChIInChI=1S/C14H15FN4O2/c1-8-2-3-18-7-10(17-12(18)4-8)14(21)19-6-9(15)5-11(19)13(16)20/h2-4,7,9,11H,5-6H2,1H3,(H2,16,20)/t9-,11+/m1/s1
InChIKeyHQXMTHHONYGQIV-KOLCDFICSA-N
MW290.30 g/mol
LogP0.68
Rot. Bonds2

About (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide

(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 120965369) has the molecular formula C14H15FN4O2 and a molecular weight of 290.30 g/mol. Its IUPAC name is (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID120965369
Molecular FormulaC14H15FN4O2
Molecular Weight290.30 g/mol
Exact Mass290.12
IUPAC Name(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCc1ccn2cc(C(=O)N3C[C@H](F)C[C@H]3C(N)=O)nc2c1
InChIInChI=1S/C14H15FN4O2/c1-8-2-3-18-7-10(17-12(18)4-8)14(21)19-6-9(15)5-11(19)13(16)20/h2-4,7,9,11H,5-6H2,1H3,(H2,16,20)/t9-,11+/m1/s1
InChIKeyHQXMTHHONYGQIV-KOLCDFICSA-N
XLogP0.68
TPSA80.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.30
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(4aR,7aS)-6,6-dioxo-1-propyl-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-4-yl]-(7-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 70726831
N'-hydroxy-7-methylimidazo[1,2-a]pyridine-2-carboximidamide
CID 83877418
(7-methylimidazo[1,2-a]pyridin-2-yl)-[(2S)-2-pyridin-4-ylazepan-1-yl]methanone
CID 94249778
(2S,4R)-4-fluoro-1-(2-phenyl-1,3-oxazole-4-carbonyl)pyrrolidine-2-carboxamide
CID 120965545
[(1S,2S)-2-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)oxycyclohexyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate
CID 124887354
thietan-3-ylmethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate
CID 166262248
[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-(7-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 120808895
N-cycloheptyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 40723824
(7-methylimidazo[1,2-a]pyridin-2-yl)-[(3S)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129327442
[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-(7-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 51257064
(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 27446583
(2S,4R)-4-fluoro-1-(2-phenylpyrimidine-5-carbonyl)pyrrolidine-2-carboxamide
CID 120965571

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide (CID 120965369) is (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide is Cc1ccn2cc(C(=O)N3C[C@H](F)C[C@H]3C(N)=O)nc2c1.
What is the InChIKey of (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is HQXMTHHONYGQIV-KOLCDFICSA-N. The full InChI is InChI=1S/C14H15FN4O2/c1-8-2-3-18-7-10(17-12(18)4-8)14(21)19-6-9(15)5-11(19)13(16)20/h2-4,7,9,11H,5-6H2,1H3,(H2,16,20)/t9-,11+/m1/s1.
What are the key properties of (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide?
(2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 290.30 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-4-fluoro-1-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 120965369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).