5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide

C16H17ClF3N5O — CID 129330222

IUPAC5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide
SMILESCN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C16H17ClF3N5O/c1-24(15-11(17)4-10(5-22-15)14(21)26)6-9-2-3-13-23-12(16(18,19)20)8-25(13)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H2,21,26)/t9-/m0/s1
InChIKeyHNYGSJCJTHPEOH-VIFPVBQESA-N
MW387.79 g/mol
LogP2.75
Rot. Bonds4

About 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide

5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide (PubChem CID 129330222) has the molecular formula C16H17ClF3N5O and a molecular weight of 387.79 g/mol. Its IUPAC name is 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide
PubChem CID129330222
Molecular FormulaC16H17ClF3N5O
Molecular Weight387.79 g/mol
Exact Mass387.11
IUPAC Name5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide
SMILESCN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C16H17ClF3N5O/c1-24(15-11(17)4-10(5-22-15)14(21)26)6-9-2-3-13-23-12(16(18,19)20)8-25(13)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H2,21,26)/t9-/m0/s1
InChIKeyHNYGSJCJTHPEOH-VIFPVBQESA-N
XLogP2.75
TPSA77.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.79
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-6-[methyl-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide
CID 129330221
5-chloro-6-[cyclopentylmethyl(methyl)amino]pyridine-3-carboxamide
CID 75418381
3-[methyl-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyrazine-2-carbonitrile
CID 129336506
2-N-methyl-2-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2,5-dicarboxamide
CID 129333834
6-ethyl-5-fluoro-N-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-4-amine
CID 129336733
5-chloro-6-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pyridine-3-carboxylic acid
CID 63273907
N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide
CID 129001119
1-methyl-3-(1-methylpyrazol-3-yl)-1-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129335103
N-methyl-5-propan-2-yl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-3-carboxamide
CID 129332582
N-methyl-5-propan-2-yl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-3-carboxamide
CID 128970412
1-methyl-3-(oxan-4-yl)-1-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 128998409
N,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]thiophene-3-carboxamide
CID 129333228

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide (CID 129330222) is 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide is CN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ncc(C(N)=O)cc1Cl.
What is the InChIKey of 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide?
The InChIKey is HNYGSJCJTHPEOH-VIFPVBQESA-N. The full InChI is InChI=1S/C16H17ClF3N5O/c1-24(15-11(17)4-10(5-22-15)14(21)26)6-9-2-3-13-23-12(16(18,19)20)8-25(13)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H2,21,26)/t9-/m0/s1.
What are the key properties of 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide?
5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide has a molecular weight of 387.79 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 129330222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).