N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide

C14H13F3N4O — CID 95136963

IUPACN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(N[C@H]1CCc2nccn2C1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H13F3N4O/c15-14(16,17)9-1-3-11(19-7-9)13(22)20-10-2-4-12-18-5-6-21(12)8-10/h1,3,5-7,10H,2,4,8H2,(H,20,22)/t10-/m0/s1
InChIKeyIMZVIXQYYVUNDN-JTQLQIEISA-N
MW310.28 g/mol
LogP2.04
Rot. Bonds2

About N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide

N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 95136963) has the molecular formula C14H13F3N4O and a molecular weight of 310.28 g/mol. Its IUPAC name is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID95136963
Molecular FormulaC14H13F3N4O
Molecular Weight310.28 g/mol
Exact Mass310.10
IUPAC NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(N[C@H]1CCc2nccn2C1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H13F3N4O/c15-14(16,17)9-1-3-11(19-7-9)13(22)20-10-2-4-12-18-5-6-21(12)8-10/h1,3,5-7,10H,2,4,8H2,(H,20,22)/t10-/m0/s1
InChIKeyIMZVIXQYYVUNDN-JTQLQIEISA-N
XLogP2.04
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.28
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide (CID 95136963) is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide is O=C(N[C@H]1CCc2nccn2C1)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is IMZVIXQYYVUNDN-JTQLQIEISA-N. The full InChI is InChI=1S/C14H13F3N4O/c15-14(16,17)9-1-3-11(19-7-9)13(22)20-10-2-4-12-18-5-6-21(12)8-10/h1,3,5-7,10H,2,4,8H2,(H,20,22)/t10-/m0/s1.
What are the key properties of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide?
N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 310.28 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 95136963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).