4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide

C15H24N4O2 — CID 62939521

IUPAC4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide
SMILESCC(C)Cn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C15H24N4O2/c1-10(2)9-19-8-7-17-14(15(19)21)18-12-5-3-11(4-6-12)13(16)20/h7-8,10-12H,3-6,9H2,1-2H3,(H2,16,20)(H,17,18)
InChIKeyHLYHTVGLVSWWIK-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.36
Rot. Bonds5

About 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide

4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide (PubChem CID 62939521) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide
PubChem CID62939521
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide
SMILESCC(C)Cn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C15H24N4O2/c1-10(2)9-19-8-7-17-14(15(19)21)18-12-5-3-11(4-6-12)13(16)20/h7-8,10-12H,3-6,9H2,1-2H3,(H2,16,20)(H,17,18)
InChIKeyHLYHTVGLVSWWIK-UHFFFAOYSA-N
XLogP1.36
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide?
The IUPAC name of 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide (CID 62939521) is 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide?
The canonical SMILES for 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide is CC(C)Cn1ccnc(NC2CCC(C(N)=O)CC2)c1=O.
What is the InChIKey of 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide?
The InChIKey is HLYHTVGLVSWWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10(2)9-19-8-7-17-14(15(19)21)18-12-5-3-11(4-6-12)13(16)20/h7-8,10-12H,3-6,9H2,1-2H3,(H2,16,20)(H,17,18).
What are the key properties of 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide?
4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 62939521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).