N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide

C14H18F3N3O — CID 155902640

IUPACN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide
SMILESO=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCC1
InChIInChI=1S/C14H18F3N3O/c15-14(16,17)11-7-18-12-6-5-10(8-20(11)12)19-13(21)9-3-1-2-4-9/h7,9-10H,1-6,8H2,(H,19,21)
InChIKeyHDWLTJRAWGYELW-UHFFFAOYSA-N
MW301.31 g/mol
LogP2.52
Rot. Bonds2

About N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide

N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide (PubChem CID 155902640) has the molecular formula C14H18F3N3O and a molecular weight of 301.31 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide
PubChem CID155902640
Molecular FormulaC14H18F3N3O
Molecular Weight301.31 g/mol
Exact Mass301.14
IUPAC NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide
SMILESO=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCC1
InChIInChI=1S/C14H18F3N3O/c15-14(16,17)11-7-18-12-6-5-10(8-20(11)12)19-13(21)9-3-1-2-4-9/h7,9-10H,1-6,8H2,(H,19,21)
InChIKeyHDWLTJRAWGYELW-UHFFFAOYSA-N
XLogP2.52
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide?
The IUPAC name of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide (CID 155902640) is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide is O=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCC1.
What is the InChIKey of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide?
The InChIKey is HDWLTJRAWGYELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3N3O/c15-14(16,17)11-7-18-12-6-5-10(8-20(11)12)19-13(21)9-3-1-2-4-9/h7,9-10H,1-6,8H2,(H,19,21).
What are the key properties of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide?
N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide has a molecular weight of 301.31 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclopentanecarboxamide is sourced from PubChem (CID 155902640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).