2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide

C19H22N6O — CID 51128541

IUPAC2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide
SMILESCCC(NC(=O)CN(C)c1cnccn1)c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C19H22N6O/c1-3-15(19-22-11-16(24-19)14-7-5-4-6-8-14)23-18(26)13-25(2)17-12-20-9-10-21-17/h4-12,15H,3,13H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyAOTJPZUMPYBUBC-UHFFFAOYSA-N
MW350.43 g/mol
LogP2.57
Rot. Bonds7

About 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide

2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide (PubChem CID 51128541) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide
PubChem CID51128541
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide
SMILESCCC(NC(=O)CN(C)c1cnccn1)c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C19H22N6O/c1-3-15(19-22-11-16(24-19)14-7-5-4-6-8-14)23-18(26)13-25(2)17-12-20-9-10-21-17/h4-12,15H,3,13H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyAOTJPZUMPYBUBC-UHFFFAOYSA-N
XLogP2.57
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide?
The IUPAC name of 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide (CID 51128541) is 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide?
The canonical SMILES for 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide is CCC(NC(=O)CN(C)c1cnccn1)c1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide?
The InChIKey is AOTJPZUMPYBUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-3-15(19-22-11-16(24-19)14-7-5-4-6-8-14)23-18(26)13-25(2)17-12-20-9-10-21-17/h4-12,15H,3,13H2,1-2H3,(H,22,24)(H,23,26).
What are the key properties of 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide?
2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide has a molecular weight of 350.43 g/mol, XLogP of 2.57, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(pyrazin-2-yl)amino]-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]acetamide is sourced from PubChem (CID 51128541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).