(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone

C18H18F3N5O — CID 166285321

IUPAC(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone
SMILESCc1nc2ccccn2c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C18H18F3N5O/c1-12-16(25-8-3-2-4-15(25)22-12)17(27)24-9-5-13(6-10-24)26-11-7-14(23-26)18(19,20)21/h2-4,7-8,11,13H,5-6,9-10H2,1H3
InChIKeyBHQCZMPLKNGSDS-UHFFFAOYSA-N
MW377.37 g/mol
LogP3.34
Rot. Bonds2

About (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone

(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone (PubChem CID 166285321) has the molecular formula C18H18F3N5O and a molecular weight of 377.37 g/mol. Its IUPAC name is (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone
PubChem CID166285321
Molecular FormulaC18H18F3N5O
Molecular Weight377.37 g/mol
Exact Mass377.15
IUPAC Name(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone
SMILESCc1nc2ccccn2c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C18H18F3N5O/c1-12-16(25-8-3-2-4-15(25)22-12)17(27)24-9-5-13(6-10-24)26-11-7-14(23-26)18(19,20)21/h2-4,7-8,11,13H,5-6,9-10H2,1H3
InChIKeyBHQCZMPLKNGSDS-UHFFFAOYSA-N
XLogP3.34
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.37
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone?
The IUPAC name of (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone (CID 166285321) is (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone.
What is the SMILES notation for (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone?
The canonical SMILES for (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone is Cc1nc2ccccn2c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1.
What is the InChIKey of (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone?
The InChIKey is BHQCZMPLKNGSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3N5O/c1-12-16(25-8-3-2-4-15(25)22-12)17(27)24-9-5-13(6-10-24)26-11-7-14(23-26)18(19,20)21/h2-4,7-8,11,13H,5-6,9-10H2,1H3.
What are the key properties of (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone?
(2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone has a molecular weight of 377.37 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 166285321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).