N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide

C23H23N5O — CID 91908395

IUPACN-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCc1cn2nc(C(=O)NCc3ccccc3)cc2c(N(C)Cc2ccccc2)n1
InChIInChI=1S/C23H23N5O/c1-17-15-28-21(22(25-17)27(2)16-19-11-7-4-8-12-19)13-20(26-28)23(29)24-14-18-9-5-3-6-10-18/h3-13,15H,14,16H2,1-2H3,(H,24,29)
InChIKeyDXXAVJSOEAWHAS-UHFFFAOYSA-N
MW385.47 g/mol
LogP3.60
Rot. Bonds6

About N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide

N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide (PubChem CID 91908395) has the molecular formula C23H23N5O and a molecular weight of 385.47 g/mol. Its IUPAC name is N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide
PubChem CID91908395
Molecular FormulaC23H23N5O
Molecular Weight385.47 g/mol
Exact Mass385.19
IUPAC NameN-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCc1cn2nc(C(=O)NCc3ccccc3)cc2c(N(C)Cc2ccccc2)n1
InChIInChI=1S/C23H23N5O/c1-17-15-28-21(22(25-17)27(2)16-19-11-7-4-8-12-19)13-20(26-28)23(29)24-14-18-9-5-3-6-10-18/h3-13,15H,14,16H2,1-2H3,(H,24,29)
InChIKeyDXXAVJSOEAWHAS-UHFFFAOYSA-N
XLogP3.60
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[benzyl(methyl)amino]-N-[(3,5-difluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide
CID 91908402
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225
2-amino-N-[[2-[benzyl(methyl)amino]-3-pyridinyl]methyl]-6-methylpyrimidine-4-carboxamide
CID 42594163
N-benzyl-1,4-dimethylimidazole-2-carboxamide
CID 145376007
N-benzyl-1-(4-methoxyphenyl)-5-methylpyrazole-3-carboxamide
CID 110373063
4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085931
2-[benzyl(ethyl)amino]-N-[(4-chlorophenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109329023
N-benzyl-4-[methyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]pyridine-2-carboxamide
CID 75463659
N-benzyl-1-(4-methylphenyl)imidazole-4-carboxamide
CID 100825109
6-methyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 155985791
N-benzyl-4-methylquinoline-2-carboxamide
CID 164678694
2-[benzyl(methyl)amino]-N-[(2-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109328208

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The IUPAC name of N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide (CID 91908395) is N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The canonical SMILES for N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide is Cc1cn2nc(C(=O)NCc3ccccc3)cc2c(N(C)Cc2ccccc2)n1.
What is the InChIKey of N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide?
The InChIKey is DXXAVJSOEAWHAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O/c1-17-15-28-21(22(25-17)27(2)16-19-11-7-4-8-12-19)13-20(26-28)23(29)24-14-18-9-5-3-6-10-18/h3-13,15H,14,16H2,1-2H3,(H,24,29).
What are the key properties of N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide?
N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[benzyl(methyl)amino]-6-methylpyrazolo[1,5-a]pyrazine-2-carboxamide is sourced from PubChem (CID 91908395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).