5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide

C16H20N4O — CID 109286874

IUPAC5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide
SMILESCCN(CC)c1cnc(C(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C16H20N4O/c1-4-20(5-2)15-12-17-14(11-18-15)16(21)19(3)13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3
InChIKeyYJIVJBWLRGJEGI-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.60
Rot. Bonds5

About 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide

5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide (PubChem CID 109286874) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide
PubChem CID109286874
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide
SMILESCCN(CC)c1cnc(C(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C16H20N4O/c1-4-20(5-2)15-12-17-14(11-18-15)16(21)19(3)13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3
InChIKeyYJIVJBWLRGJEGI-UHFFFAOYSA-N
XLogP2.60
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The IUPAC name of 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide (CID 109286874) is 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The canonical SMILES for 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide is CCN(CC)c1cnc(C(=O)N(C)c2ccccc2)cn1.
What is the InChIKey of 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The InChIKey is YJIVJBWLRGJEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-4-20(5-2)15-12-17-14(11-18-15)16(21)19(3)13-9-7-6-8-10-13/h6-12H,4-5H2,1-3H3.
What are the key properties of 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide?
5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.60, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylamino)-N-methyl-N-phenylpyrazine-2-carboxamide is sourced from PubChem (CID 109286874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).