(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone

C14H16FN3O2 — CID 126438159

IUPAC(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone
SMILESCc1ccc2nc(C(=O)N3CC[C@@H](CO)C3)c(F)n2c1
InChIInChI=1S/C14H16FN3O2/c1-9-2-3-11-16-12(13(15)18(11)6-9)14(20)17-5-4-10(7-17)8-19/h2-3,6,10,19H,4-5,7-8H2,1H3/t10-/m1/s1
InChIKeyQQEUYITYCBEHRQ-SNVBAGLBSA-N
MW277.30 g/mol
LogP1.24
Rot. Bonds2

About (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone

(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone (PubChem CID 126438159) has the molecular formula C14H16FN3O2 and a molecular weight of 277.30 g/mol. Its IUPAC name is (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone
PubChem CID126438159
Molecular FormulaC14H16FN3O2
Molecular Weight277.30 g/mol
Exact Mass277.12
IUPAC Name(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone
SMILESCc1ccc2nc(C(=O)N3CC[C@@H](CO)C3)c(F)n2c1
InChIInChI=1S/C14H16FN3O2/c1-9-2-3-11-16-12(13(15)18(11)6-9)14(20)17-5-4-10(7-17)8-19/h2-3,6,10,19H,4-5,7-8H2,1H3/t10-/m1/s1
InChIKeyQQEUYITYCBEHRQ-SNVBAGLBSA-N
XLogP1.24
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(2-hydroxypropan-2-yl)pyrrolidin-1-yl]methanone
CID 125177540
N-[1-(3-fluoro-6-methylimidazo[1,2-a]pyridine-2-carbonyl)piperidin-4-yl]methanesulfonamide
CID 72926714
(3-ethyl-4-propan-2-ylpiperazin-1-yl)-(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 72908166
(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(1R,5R)-6-(3-methylbut-2-enyl)-3,6-diazabicyclo[3.2.2]nonan-3-yl]methanone
CID 70727283
(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3S,4R)-3-hydroxy-4-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-yl]methanone
CID 135104908
(2,5-dimethylphenyl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 62370766
(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-(7-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 164694949
1-(6-chloro-3-fluoroimidazo[1,2-a]pyridine-2-carbonyl)-N,N-diethylpiperidine-3-carboxamide
CID 77087302
(4-fluoro-3-methylphenyl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 55163647
(6-bromo-3-fluoroimidazo[1,2-a]pyridin-2-yl)-[(3R,4S)-3,4-difluoropyrrolidin-1-yl]methanone
CID 136585374
(2-amino-5-methylphenyl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 112623690
[3-(hydroxymethyl)pyrrolidin-1-yl]-(1-methylindazol-3-yl)methanone
CID 103120147

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone (CID 126438159) is (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone is Cc1ccc2nc(C(=O)N3CC[C@@H](CO)C3)c(F)n2c1.
What is the InChIKey of (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone?
The InChIKey is QQEUYITYCBEHRQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H16FN3O2/c1-9-2-3-11-16-12(13(15)18(11)6-9)14(20)17-5-4-10(7-17)8-19/h2-3,6,10,19H,4-5,7-8H2,1H3/t10-/m1/s1.
What are the key properties of (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone?
(3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone has a molecular weight of 277.30 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 126438159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).