N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide

C13H18N6O — CID 97384444

IUPACN,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
SMILESCN(C)C(=O)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C13H18N6O/c1-16(2)13(20)17-6-7-19-11(8-14-12(19)10-17)9-18-5-3-4-15-18/h3-5,8H,6-7,9-10H2,1-2H3
InChIKeyOGLTYNZEYYTTJA-UHFFFAOYSA-N
MW274.33 g/mol
LogP0.63
Rot. Bonds2

About N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide

N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide (PubChem CID 97384444) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
PubChem CID97384444
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC NameN,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
SMILESCN(C)C(=O)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C13H18N6O/c1-16(2)13(20)17-6-7-19-11(8-14-12(19)10-17)9-18-5-3-4-15-18/h3-5,8H,6-7,9-10H2,1-2H3
InChIKeyOGLTYNZEYYTTJA-UHFFFAOYSA-N
XLogP0.63
TPSA59.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The IUPAC name of N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide (CID 97384444) is N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The canonical SMILES for N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide is CN(C)C(=O)N1CCn2c(Cn3cccn3)cnc2C1.
What is the InChIKey of N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The InChIKey is OGLTYNZEYYTTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-16(2)13(20)17-6-7-19-11(8-14-12(19)10-17)9-18-5-3-4-15-18/h3-5,8H,6-7,9-10H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide has a molecular weight of 274.33 g/mol, XLogP of 0.63, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide is sourced from PubChem (CID 97384444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).