N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide

C13H20N4O2 — CID 109273887

IUPACN-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
SMILESCOCCNc1cnc(C(=O)NC2CCCC2)cn1
InChIInChI=1S/C13H20N4O2/c1-19-7-6-14-12-9-15-11(8-16-12)13(18)17-10-4-2-3-5-10/h8-10H,2-7H2,1H3,(H,14,16)(H,17,18)
InChIKeyFWYCAKGFYPSUAE-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.21
Rot. Bonds6

About N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide

N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide (PubChem CID 109273887) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
PubChem CID109273887
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
SMILESCOCCNc1cnc(C(=O)NC2CCCC2)cn1
InChIInChI=1S/C13H20N4O2/c1-19-7-6-14-12-9-15-11(8-16-12)13(18)17-10-4-2-3-5-10/h8-10H,2-7H2,1H3,(H,14,16)(H,17,18)
InChIKeyFWYCAKGFYPSUAE-UHFFFAOYSA-N
XLogP1.21
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide (CID 109273887) is N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide is COCCNc1cnc(C(=O)NC2CCCC2)cn1.
What is the InChIKey of N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The InChIKey is FWYCAKGFYPSUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-19-7-6-14-12-9-15-11(8-16-12)13(18)17-10-4-2-3-5-10/h8-10H,2-7H2,1H3,(H,14,16)(H,17,18).
What are the key properties of N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109273887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).