N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide

C22H19N3O — CID 122393153

IUPACN-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cn2cccc2c(-c2ccccc2)n1
InChIInChI=1S/C22H19N3O/c1-24(15-17-9-4-2-5-10-17)22(26)19-16-25-14-8-13-20(25)21(23-19)18-11-6-3-7-12-18/h2-14,16H,15H2,1H3
InChIKeyQFYYHTVZHIEVCW-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.27
Rot. Bonds4

About N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide

N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide (PubChem CID 122393153) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide
PubChem CID122393153
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC NameN-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cn2cccc2c(-c2ccccc2)n1
InChIInChI=1S/C22H19N3O/c1-24(15-17-9-4-2-5-10-17)22(26)19-16-25-14-8-13-20(25)21(23-19)18-11-6-3-7-12-18/h2-14,16H,15H2,1H3
InChIKeyQFYYHTVZHIEVCW-UHFFFAOYSA-N
XLogP4.27
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 53189002
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CID 1097403
N-benzyl-N,7-dimethyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 1103631
N-benzyl-N-methyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-2-carboxamide
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N-benzyl-4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-N-methylbenzamide
CID 31702932
N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,6-dimethylpyridine-2-carboxamide
CID 32771148
2-(azepan-1-yl)-N-benzyl-N-methylpyrimidine-4-carboxamide
CID 109305153
methyl 2-[imidazo[1,2-a]pyridine-2-carbonyl(methyl)amino]acetate
CID 43408804
N-benzyl-N,1-dimethylindazole-3-carboxamide
CID 110851100
1-N-benzyl-3-N-butyl-1-N,3-N-dimethylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070445
N-benzyl-N-methyl-2-phenyl-6-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 112851483
6-N-benzyl-6-N-methyl-2-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097660

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide (CID 122393153) is N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide is CN(Cc1ccccc1)C(=O)c1cn2cccc2c(-c2ccccc2)n1.
What is the InChIKey of N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is QFYYHTVZHIEVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-24(15-17-9-4-2-5-10-17)22(26)19-16-25-14-8-13-20(25)21(23-19)18-11-6-3-7-12-18/h2-14,16H,15H2,1H3.
What are the key properties of N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide?
N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-phenylpyrrolo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 122393153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).