N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide

C22H19N5O2 — CID 175388250

IUPACN-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide
SMILESCC(=O)NCNC(=O)c1ccc(-c2ncc3cnc(-c4ccccc4)cn23)cc1
InChIInChI=1S/C22H19N5O2/c1-15(28)25-14-26-22(29)18-9-7-17(8-10-18)21-24-12-19-11-23-20(13-27(19)21)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,25,28)(H,26,29)
InChIKeyUVDLPRDUMALQFU-UHFFFAOYSA-N
MW385.43 g/mol
LogP2.89
Rot. Bonds5

About N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide

N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide (PubChem CID 175388250) has the molecular formula C22H19N5O2 and a molecular weight of 385.43 g/mol. Its IUPAC name is N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide.

Molecular Properties

Compound NameN-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide
PubChem CID175388250
Molecular FormulaC22H19N5O2
Molecular Weight385.43 g/mol
Exact Mass385.15
IUPAC NameN-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide
SMILESCC(=O)NCNC(=O)c1ccc(-c2ncc3cnc(-c4ccccc4)cn23)cc1
InChIInChI=1S/C22H19N5O2/c1-15(28)25-14-26-22(29)18-9-7-17(8-10-18)21-24-12-19-11-23-20(13-27(19)21)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,25,28)(H,26,29)
InChIKeyUVDLPRDUMALQFU-UHFFFAOYSA-N
XLogP2.89
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.43
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-[6-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]benzamide
CID 156503074
4-(6-phenyl-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)benzoic acid
CID 156503118
3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 84737805
N-(3-acetamidopropyl)-4-phenylbenzamide
CID 38450168
2-[(6-phenylpyridine-3-carbonyl)amino]ethylcarbamic acid
CID 135122283
N-[(6-phenyl-3-pyridinyl)methyl]acetamide
CID 143102890
N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
CID 110683628
N-[3-(dimethylamino)propyl]-4-[3-(3-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide
CID 126672927
N-[2-(dimethylamino)ethyl]-4-(2,6-diphenyl-4-pyridinyl)benzamide;dihydrochloride
CID 67598283
N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-phenylbenzamide
CID 37018718
2-[[4-(5-chloro-2-pyridinyl)benzoyl]amino]acetic acid
CID 169198581
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-4-phenylbenzamide
CID 110660378

Frequently Asked Questions

What is the IUPAC name of N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide?
The IUPAC name of N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide (CID 175388250) is N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide.
What is the SMILES notation for N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide?
The canonical SMILES for N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide is CC(=O)NCNC(=O)c1ccc(-c2ncc3cnc(-c4ccccc4)cn23)cc1.
What is the InChIKey of N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide?
The InChIKey is UVDLPRDUMALQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O2/c1-15(28)25-14-26-22(29)18-9-7-17(8-10-18)21-24-12-19-11-23-20(13-27(19)21)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,25,28)(H,26,29).
What are the key properties of N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide?
N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide has a molecular weight of 385.43 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(acetamidomethyl)-4-(6-phenylimidazo[1,5-a]pyrazin-3-yl)benzamide is sourced from PubChem (CID 175388250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).