3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide

C10H17N5O2 — CID 83039830

IUPAC3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide
SMILESCOCCNCCNc1nccnc1C(N)=O
InChIInChI=1S/C10H17N5O2/c1-17-7-6-12-2-3-14-10-8(9(11)16)13-4-5-15-10/h4-5,12H,2-3,6-7H2,1H3,(H2,11,16)(H,14,15)
InChIKeyDDYVAOBGIGAESA-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.78
Rot. Bonds8

About 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide

3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide (PubChem CID 83039830) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide
PubChem CID83039830
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide
SMILESCOCCNCCNc1nccnc1C(N)=O
InChIInChI=1S/C10H17N5O2/c1-17-7-6-12-2-3-14-10-8(9(11)16)13-4-5-15-10/h4-5,12H,2-3,6-7H2,1H3,(H2,11,16)(H,14,15)
InChIKeyDDYVAOBGIGAESA-UHFFFAOYSA-N
XLogP-0.78
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3,6-bis(3-methoxypropylamino)pyrazine-2,5-dicarboxamide
CID 58462499
3-[2-(4-aminocyclohexyl)oxyethylamino]pyrazine-2-carboxamide
CID 63870860
2-[(3-carbamoylpyrazin-2-yl)amino]acetic acid
CID 62684494
3-(2-aminopropylamino)pyrazine-2-carboxamide
CID 63732548
N-(2-methoxyethyl)-N'-(7-methoxyisoquinolin-1-yl)ethane-1,2-diamine
CID 106541048
2-[[3-(2-methoxyethylamino)-3-oxopropyl]amino]pyridine-3-carboxamide
CID 112686364
N-(2-methoxyethyl)-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 83029559
methyl 4-[2-(2-methoxyethylamino)ethylamino]pyridine-2-carboxylate
CID 83029565
5-acetyl-3,6-bis[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]propylamino]pyrazine-2-carboxamide
CID 58462486
N'-(3,6-dimethylpyrazin-2-yl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 83029881
N-[2-(2-methoxyethylamino)ethyl]-2-pyridin-4-ylacetamide
CID 83039476
CID 159139030
CID 159139030

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide?
The IUPAC name of 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide (CID 83039830) is 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide.
What is the SMILES notation for 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide?
The canonical SMILES for 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide is COCCNCCNc1nccnc1C(N)=O.
What is the InChIKey of 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide?
The InChIKey is DDYVAOBGIGAESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-17-7-6-12-2-3-14-10-8(9(11)16)13-4-5-15-10/h4-5,12H,2-3,6-7H2,1H3,(H2,11,16)(H,14,15).
What are the key properties of 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide?
3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide has a molecular weight of 239.28 g/mol, XLogP of -0.78, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethylamino)ethylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 83039830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).