N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide

C14H20N6O — CID 97467591

IUPACN-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide
SMILESCCN1CCn2cc(CNC(=O)c3cnn(C)c3)nc2C1
InChIInChI=1S/C14H20N6O/c1-3-19-4-5-20-9-12(17-13(20)10-19)7-15-14(21)11-6-16-18(2)8-11/h6,8-9H,3-5,7,10H2,1-2H3,(H,15,21)
InChIKeyIUTFXZYIWGTZHF-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.38
Rot. Bonds4

About N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide

N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide (PubChem CID 97467591) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide
PubChem CID97467591
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC NameN-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide
SMILESCCN1CCn2cc(CNC(=O)c3cnn(C)c3)nc2C1
InChIInChI=1S/C14H20N6O/c1-3-19-4-5-20-9-12(17-13(20)10-19)7-15-14(21)11-6-16-18(2)8-11/h6,8-9H,3-5,7,10H2,1-2H3,(H,15,21)
InChIKeyIUTFXZYIWGTZHF-UHFFFAOYSA-N
XLogP0.38
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide?
The IUPAC name of N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide (CID 97467591) is N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide.
What is the SMILES notation for N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide?
The canonical SMILES for N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide is CCN1CCn2cc(CNC(=O)c3cnn(C)c3)nc2C1.
What is the InChIKey of N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide?
The InChIKey is IUTFXZYIWGTZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-3-19-4-5-20-9-12(17-13(20)10-19)7-15-14(21)11-6-16-18(2)8-11/h6,8-9H,3-5,7,10H2,1-2H3,(H,15,21).
What are the key properties of N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide?
N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide is sourced from PubChem (CID 97467591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).