N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

C15H15N5O — CID 103120624

IUPACN-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCNCc1cccc(NC(=O)c2cnn3ccncc23)c1
InChIInChI=1S/C15H15N5O/c1-16-8-11-3-2-4-12(7-11)19-15(21)13-9-18-20-6-5-17-10-14(13)20/h2-7,9-10,16H,8H2,1H3,(H,19,21)
InChIKeyZDPQJOQKSZWRHM-UHFFFAOYSA-N
MW281.32 g/mol
LogP1.70
Rot. Bonds4

About N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 103120624) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID103120624
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC NameN-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCNCc1cccc(NC(=O)c2cnn3ccncc23)c1
InChIInChI=1S/C15H15N5O/c1-16-8-11-3-2-4-12(7-11)19-15(21)13-9-18-20-6-5-17-10-14(13)20/h2-7,9-10,16H,8H2,1H3,(H,19,21)
InChIKeyZDPQJOQKSZWRHM-UHFFFAOYSA-N
XLogP1.70
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-hydroxy-4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103119627
N-(3-amino-4-methoxyphenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103116298
3-hydroxy-2-methyl-N-[3-(methylaminomethyl)phenyl]benzamide
CID 82830003
N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 167803256
5-fluoro-N-[3-(methylaminomethyl)phenyl]pyridine-3-carboxamide
CID 115736760
2,3-dichloro-N-[3-(methylaminomethyl)phenyl]benzamide
CID 43601974
N-(2-amino-6-chlorophenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103116169
5-methyl-N-[3-(methylaminomethyl)phenyl]pyrazine-2-carboxamide
CID 43601855
2-hydroxy-5-iodo-N-[3-(methylaminomethyl)phenyl]benzamide
CID 107732038
3-methyl-N-[3-(methylaminomethyl)phenyl]pyridine-2-carboxamide
CID 55060469
5-fluoro-2-hydroxy-N-[3-(methylaminomethyl)phenyl]benzamide
CID 115299348
N-(2-chloro-4-cyanophenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 107808178

Frequently Asked Questions

What is the IUPAC name of N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (CID 103120624) is N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is CNCc1cccc(NC(=O)c2cnn3ccncc23)c1.
What is the InChIKey of N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is ZDPQJOQKSZWRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-16-8-11-3-2-4-12(7-11)19-15(21)13-9-18-20-6-5-17-10-14(13)20/h2-7,9-10,16H,8H2,1H3,(H,19,21).
What are the key properties of N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methylaminomethyl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 103120624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).