(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide

C17H17F5N6O2 — CID 137452738

IUPAC(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
SMILESC[C@@H]1Cn2cnc(C(=O)N[C@H](C)C(F)(F)F)c2CN1C(=O)Nc1cc(F)nc(F)c1
InChIInChI=1S/C17H17F5N6O2/c1-8-5-27-7-23-14(15(29)24-9(2)17(20,21)22)11(27)6-28(8)16(30)25-10-3-12(18)26-13(19)4-10/h3-4,7-9H,5-6H2,1-2H3,(H,24,29)(H,25,26,30)/t8-,9-/m1/s1
InChIKeyMVCLQHLBEYLALP-RKDXNWHRSA-N
MW432.35 g/mol
LogP2.67
Rot. Bonds3

About (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide

(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide (PubChem CID 137452738) has the molecular formula C17H17F5N6O2 and a molecular weight of 432.35 g/mol. Its IUPAC name is (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide.

Molecular Properties

Compound Name(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
PubChem CID137452738
Molecular FormulaC17H17F5N6O2
Molecular Weight432.35 g/mol
Exact Mass432.13
IUPAC Name(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
SMILESC[C@@H]1Cn2cnc(C(=O)N[C@H](C)C(F)(F)F)c2CN1C(=O)Nc1cc(F)nc(F)c1
InChIInChI=1S/C17H17F5N6O2/c1-8-5-27-7-23-14(15(29)24-9(2)17(20,21)22)11(27)6-28(8)16(30)25-10-3-12(18)26-13(19)4-10/h3-4,7-9H,5-6H2,1-2H3,(H,24,29)(H,25,26,30)/t8-,9-/m1/s1
InChIKeyMVCLQHLBEYLALP-RKDXNWHRSA-N
XLogP2.67
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.35
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide with MolForge

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

Launch Full Analysis

Related Compounds

(6R)-5-N-(3,4-difluorophenyl)-6-methyl-3-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3,5-dicarboxamide
CID 137452622
(6S)-7-N-(3-cyano-4-fluorophenyl)-1-N-[(2R)-1-fluoropropan-2-yl]-6-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
CID 137452703
(6R)-N-(3-cyano-4-fluorophenyl)-6-methyl-1-[(3R)-4,4,4-trifluoro-3-methylbutanoyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 158611707
(6S)-5-N-(3-cyano-4-fluorophenyl)-6-methyl-3-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3,5-dicarboxamide
CID 137452620
7-[(3-cyano-4-fluorophenyl)carbamoyl]-6-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 146590826
7-(1H-indole-2-carbonyl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxamide
CID 155260039
(6S)-N-(2,6-difluoro-4-pyridinyl)-6-methyl-3-[(4S)-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
CID 145440353
(6S)-3-(5-fluoro-2-pyridinyl)-6-methyl-N-(3,4,5-trifluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
CID 121484200
(6S)-3-(5-fluoropyrimidin-2-yl)-6-methyl-N-(3,4,5-trifluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
CID 121484522
(6S)-5-N-(3,4-difluorophenyl)-6-[2-[[(2S)-1-hydroxypropan-2-yl]amino]-2-(4-methoxyphenyl)ethyl]-3-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,7-dihydro-4H-triazolo[1,5-a]pyrazine-3,5-dicarboxamide
CID 146615356
3-cyclopentyl-6-methyl-N-(3,4,5-trifluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
CID 121483794
(6S)-3-(4-hydroxy-3-methyl-1,1-dioxo-1,2-thiazolidin-2-yl)-6-methyl-N-(3,4,5-trifluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
CID 134182632

Frequently Asked Questions

What is the IUPAC name of (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide?
The IUPAC name of (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide (CID 137452738) is (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide.
What is the SMILES notation for (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide?
The canonical SMILES for (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide is C[C@@H]1Cn2cnc(C(=O)N[C@H](C)C(F)(F)F)c2CN1C(=O)Nc1cc(F)nc(F)c1.
What is the InChIKey of (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide?
The InChIKey is MVCLQHLBEYLALP-RKDXNWHRSA-N. The full InChI is InChI=1S/C17H17F5N6O2/c1-8-5-27-7-23-14(15(29)24-9(2)17(20,21)22)11(27)6-28(8)16(30)25-10-3-12(18)26-13(19)4-10/h3-4,7-9H,5-6H2,1-2H3,(H,24,29)(H,25,26,30)/t8-,9-/m1/s1.
What are the key properties of (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide?
(6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide has a molecular weight of 432.35 g/mol, XLogP of 2.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-7-N-(2,6-difluoro-4-pyridinyl)-6-methyl-1-N-[(2R)-1,1,1-trifluoropropan-2-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide is sourced from PubChem (CID 137452738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).