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

C13H20N4O2 — CID 62939354

IUPAC4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide
SMILESCCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C13H20N4O2/c1-2-17-8-7-15-12(13(17)19)16-10-5-3-9(4-6-10)11(14)18/h7-10H,2-6H2,1H3,(H2,14,18)(H,15,16)
InChIKeyHBJUZPIAJMNSFE-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.72
Rot. Bonds4

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

4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide (PubChem CID 62939354) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide
PubChem CID62939354
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide
SMILESCCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C13H20N4O2/c1-2-17-8-7-15-12(13(17)19)16-10-5-3-9(4-6-10)11(14)18/h7-10H,2-6H2,1H3,(H2,14,18)(H,15,16)
InChIKeyHBJUZPIAJMNSFE-UHFFFAOYSA-N
XLogP0.72
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The IUPAC name of 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide (CID 62939354) is 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The canonical SMILES for 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide is CCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O.
What is the InChIKey of 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The InChIKey is HBJUZPIAJMNSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-17-8-7-15-12(13(17)19)16-10-5-3-9(4-6-10)11(14)18/h7-10H,2-6H2,1H3,(H2,14,18)(H,15,16).
What are the key properties of 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide?
4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 62939354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).