N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide

C20H24N6O2 — CID 72885110

IUPACN,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
SMILESCN(C)C(=O)N1CCn2nc(CNC(=O)c3cc4ccccc4n3C)cc2C1
InChIInChI=1S/C20H24N6O2/c1-23(2)20(28)25-8-9-26-16(13-25)11-15(22-26)12-21-19(27)18-10-14-6-4-5-7-17(14)24(18)3/h4-7,10-11H,8-9,12-13H2,1-3H3,(H,21,27)
InChIKeyLUQZVIYDGXXMEU-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.80
Rot. Bonds3

About N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide

N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide (PubChem CID 72885110) has the molecular formula C20H24N6O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
PubChem CID72885110
Molecular FormulaC20H24N6O2
Molecular Weight380.45 g/mol
Exact Mass380.20
IUPAC NameN,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
SMILESCN(C)C(=O)N1CCn2nc(CNC(=O)c3cc4ccccc4n3C)cc2C1
InChIInChI=1S/C20H24N6O2/c1-23(2)20(28)25-8-9-26-16(13-25)11-15(22-26)12-21-19(27)18-10-14-6-4-5-7-17(14)24(18)3/h4-7,10-11H,8-9,12-13H2,1-3H3,(H,21,27)
InChIKeyLUQZVIYDGXXMEU-UHFFFAOYSA-N
XLogP1.80
TPSA75.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The IUPAC name of N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide (CID 72885110) is N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The canonical SMILES for N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide is CN(C)C(=O)N1CCn2nc(CNC(=O)c3cc4ccccc4n3C)cc2C1.
What is the InChIKey of N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The InChIKey is LUQZVIYDGXXMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O2/c1-23(2)20(28)25-8-9-26-16(13-25)11-15(22-26)12-21-19(27)18-10-14-6-4-5-7-17(14)24(18)3/h4-7,10-11H,8-9,12-13H2,1-3H3,(H,21,27).
What are the key properties of N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[(1-methylindole-2-carbonyl)amino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide is sourced from PubChem (CID 72885110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).