N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide

C22H24N4O — CID 160873477

IUPACN-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CN2CCn3c(cnc3Cc3ccccc3)C2)cc1
InChIInChI=1S/C22H24N4O/c1-17(27)24-20-9-7-19(8-10-20)15-25-11-12-26-21(16-25)14-23-22(26)13-18-5-3-2-4-6-18/h2-10,14H,11-13,15-16H2,1H3,(H,24,27)
InChIKeySMBKQTDZBWFIOH-UHFFFAOYSA-N
MW360.46 g/mol
LogP3.45
Rot. Bonds5

About N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide

N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide (PubChem CID 160873477) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide
PubChem CID160873477
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC NameN-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CN2CCn3c(cnc3Cc3ccccc3)C2)cc1
InChIInChI=1S/C22H24N4O/c1-17(27)24-20-9-7-19(8-10-20)15-25-11-12-26-21(16-25)14-23-22(26)13-18-5-3-2-4-6-18/h2-10,14H,11-13,15-16H2,1H3,(H,24,27)
InChIKeySMBKQTDZBWFIOH-UHFFFAOYSA-N
XLogP3.45
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide with MolForge

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Related Compounds

1-(7-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylmethanamine
CID 67242840
7-benzyl-N-methyl-N-phenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-amine;deuterio(fluoro)methane;3,7-dibenzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 159055377
3-benzyl-7-(cyclohexylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine;2,2,2-trifluoroacetic acid
CID 118173675
N-(7-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl)-N-phenylpropanamide
CID 118173680
[(7-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl)-cyclopropylmethyl] acetate
CID 22335359
N-[6-[4-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]phenoxy]-3-pyridinyl]acetamide
CID 143176119
N-(2-benzyl-1,3-dihydroisoindol-5-yl)acetamide
CID 15167888
N-[4-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]phenyl]acetamide
CID 23826694
N-[4-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]phenyl]acetamide
CID 3793854
N-[4-[[4-(5-chloro-2-pyridinyl)piperazin-1-yl]methyl]phenyl]acetamide
CID 122157779
N-[4-[[4-(6-chloropyrimidin-4-yl)-3-oxopiperazin-1-yl]methyl]phenyl]acetamide
CID 134792303
N-[4-[[(3R)-3-(2-hydroxyethyl)-4-(2-phenylethyl)piperazin-1-yl]methyl]phenyl]acetamide
CID 93233392

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide?
The IUPAC name of N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide (CID 160873477) is N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide is CC(=O)Nc1ccc(CN2CCn3c(cnc3Cc3ccccc3)C2)cc1.
What is the InChIKey of N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide?
The InChIKey is SMBKQTDZBWFIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c1-17(27)24-20-9-7-19(8-10-20)15-25-11-12-26-21(16-25)14-23-22(26)13-18-5-3-2-4-6-18/h2-10,14H,11-13,15-16H2,1H3,(H,24,27).
What are the key properties of N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide?
N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide has a molecular weight of 360.46 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-benzyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)methyl]phenyl]acetamide is sourced from PubChem (CID 160873477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).