N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide

C14H14F2N4O — CID 143807588

IUPACN-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide
SMILESO=C(Nc1nc(C(F)F)n2c1CNCC2)c1ccccc1
InChIInChI=1S/C14H14F2N4O/c15-11(16)13-18-12(10-8-17-6-7-20(10)13)19-14(21)9-4-2-1-3-5-9/h1-5,11,17H,6-8H2,(H,19,21)
InChIKeyYTLVGQPGEGDRJA-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.18
Rot. Bonds3

About N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide

N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide (PubChem CID 143807588) has the molecular formula C14H14F2N4O and a molecular weight of 292.29 g/mol. Its IUPAC name is N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide.

Molecular Properties

Compound NameN-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide
PubChem CID143807588
Molecular FormulaC14H14F2N4O
Molecular Weight292.29 g/mol
Exact Mass292.11
IUPAC NameN-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide
SMILESO=C(Nc1nc(C(F)F)n2c1CNCC2)c1ccccc1
InChIInChI=1S/C14H14F2N4O/c15-11(16)13-18-12(10-8-17-6-7-20(10)13)19-14(21)9-4-2-1-3-5-9/h1-5,11,17H,6-8H2,(H,19,21)
InChIKeyYTLVGQPGEGDRJA-UHFFFAOYSA-N
XLogP2.18
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide
CID 76848918
1-benzamido-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylic acid
CID 174593418
N-[1-(methylamino)-1-oxopropan-2-yl]-3-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
CID 66932130
N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 70303028
N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide
CID 174547037
N-[6-[2-(4-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl]imidazo[1,2-b]pyridazin-2-yl]pyridine-4-carboxamide
CID 118538978
N-[7-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl]benzamide
CID 44513417
3-benzamido-1H-1,2,4-triazole-5-carboxylic acid
CID 4299117
N-(5-fluoro-1H-1,2,4-triazol-3-yl)benzamide
CID 174732439
bis(2-benzamidobenzoic acid);piperazine
CID 3045073
3-fluoro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494063
4-fluoro-N-[4-(4-phenylpiperazin-1-yl)phenyl]benzamide
CID 112983940

Frequently Asked Questions

What is the IUPAC name of N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide?
The IUPAC name of N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide (CID 143807588) is N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide.
What is the SMILES notation for N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide?
The canonical SMILES for N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide is O=C(Nc1nc(C(F)F)n2c1CNCC2)c1ccccc1.
What is the InChIKey of N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide?
The InChIKey is YTLVGQPGEGDRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N4O/c15-11(16)13-18-12(10-8-17-6-7-20(10)13)19-14(21)9-4-2-1-3-5-9/h1-5,11,17H,6-8H2,(H,19,21).
What are the key properties of N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide?
N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide has a molecular weight of 292.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]benzamide is sourced from PubChem (CID 143807588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).