N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide

C15H18N6O2 — CID 118741469

IUPACN-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1(c2cnccn2)CCCN1C(=O)c1ccn(C)n1
InChIInChI=1S/C15H18N6O2/c1-16-14(23)15(12-10-17-6-7-18-12)5-3-8-21(15)13(22)11-4-9-20(2)19-11/h4,6-7,9-10H,3,5,8H2,1-2H3,(H,16,23)
InChIKeyLCPGWSSOBDVKCE-UHFFFAOYSA-N
MW314.35 g/mol
LogP0.09
Rot. Bonds3

About N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide

N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide (PubChem CID 118741469) has the molecular formula C15H18N6O2 and a molecular weight of 314.35 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide
PubChem CID118741469
Molecular FormulaC15H18N6O2
Molecular Weight314.35 g/mol
Exact Mass314.15
IUPAC NameN-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1(c2cnccn2)CCCN1C(=O)c1ccn(C)n1
InChIInChI=1S/C15H18N6O2/c1-16-14(23)15(12-10-17-6-7-18-12)5-3-8-21(15)13(22)11-4-9-20(2)19-11/h4,6-7,9-10H,3,5,8H2,1-2H3,(H,16,23)
InChIKeyLCPGWSSOBDVKCE-UHFFFAOYSA-N
XLogP0.09
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide (CID 118741469) is N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide is CNC(=O)C1(c2cnccn2)CCCN1C(=O)c1ccn(C)n1.
What is the InChIKey of N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The InChIKey is LCPGWSSOBDVKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O2/c1-16-14(23)15(12-10-17-6-7-18-12)5-3-8-21(15)13(22)11-4-9-20(2)19-11/h4,6-7,9-10H,3,5,8H2,1-2H3,(H,16,23).
What are the key properties of N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide has a molecular weight of 314.35 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrazole-3-carbonyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 118741469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).