N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide

C20H24N4O2 — CID 11348741

IUPACN-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC(C)(C)Oc1ccc(NC(=O)N2CC=C(c3cnccn3)CC2)cc1
InChIInChI=1S/C20H24N4O2/c1-20(2,3)26-17-6-4-16(5-7-17)23-19(25)24-12-8-15(9-13-24)18-14-21-10-11-22-18/h4-8,10-11,14H,9,12-13H2,1-3H3,(H,23,25)
InChIKeyWRXUJYUSLXEWHO-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.98
Rot. Bonds3

About N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide

N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 11348741) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID11348741
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC(C)(C)Oc1ccc(NC(=O)N2CC=C(c3cnccn3)CC2)cc1
InChIInChI=1S/C20H24N4O2/c1-20(2,3)26-17-6-4-16(5-7-17)23-19(25)24-12-8-15(9-13-24)18-14-21-10-11-22-18/h4-8,10-11,14H,9,12-13H2,1-3H3,(H,23,25)
InChIKeyWRXUJYUSLXEWHO-UHFFFAOYSA-N
XLogP3.98
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 11348741) is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide is CC(C)(C)Oc1ccc(NC(=O)N2CC=C(c3cnccn3)CC2)cc1.
What is the InChIKey of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is WRXUJYUSLXEWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-20(2,3)26-17-6-4-16(5-7-17)23-19(25)24-12-8-15(9-13-24)18-14-21-10-11-22-18/h4-8,10-11,14H,9,12-13H2,1-3H3,(H,23,25).
What are the key properties of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide?
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 11348741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).