2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol

C14H16F3N3O — CID 75370687

IUPAC2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol
SMILESOC(C1CCCN1Cc1cn2ccccc2n1)C(F)(F)F
InChIInChI=1S/C14H16F3N3O/c15-14(16,17)13(21)11-4-3-7-19(11)8-10-9-20-6-2-1-5-12(20)18-10/h1-2,5-6,9,11,13,21H,3-4,7-8H2
InChIKeyQAIXLNLSZWERON-UHFFFAOYSA-N
MW299.30 g/mol
LogP2.22
Rot. Bonds3

About 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol

2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol (PubChem CID 75370687) has the molecular formula C14H16F3N3O and a molecular weight of 299.30 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol
PubChem CID75370687
Molecular FormulaC14H16F3N3O
Molecular Weight299.30 g/mol
Exact Mass299.12
IUPAC Name2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol
SMILESOC(C1CCCN1Cc1cn2ccccc2n1)C(F)(F)F
InChIInChI=1S/C14H16F3N3O/c15-14(16,17)13(21)11-4-3-7-19(11)8-10-9-20-6-2-1-5-12(20)18-10/h1-2,5-6,9,11,13,21H,3-4,7-8H2
InChIKeyQAIXLNLSZWERON-UHFFFAOYSA-N
XLogP2.22
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.30
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol with MolForge

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Related Compounds

[(2R)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]methanol
CID 62736748
methyl 1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidine-2-carboxylate
CID 62025948
(2S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidine-2-carboxamide
CID 95173777
(4aS,8aR)-4-(imidazo[1,2-a]pyridin-2-ylmethyl)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine
CID 95576057
1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-3-ol
CID 62918360
(3S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-3-amine
CID 129366305
2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 56780480
N-[[1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-2-yl]methyl]ethanamine
CID 62580932
1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidine-3-carboxylic acid
CID 43385952
2-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 7039929
2-[(2,6-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridine bromide
CID 53347072
2-[(3-bromopyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 80677191

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol?
The IUPAC name of 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol (CID 75370687) is 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol.
What is the SMILES notation for 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol?
The canonical SMILES for 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol is OC(C1CCCN1Cc1cn2ccccc2n1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol?
The InChIKey is QAIXLNLSZWERON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N3O/c15-14(16,17)13(21)11-4-3-7-19(11)8-10-9-20-6-2-1-5-12(20)18-10/h1-2,5-6,9,11,13,21H,3-4,7-8H2.
What are the key properties of 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol?
2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol has a molecular weight of 299.30 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-2-yl]ethanol is sourced from PubChem (CID 75370687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).