3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol

C10H17N3O — CID 65239954

IUPAC3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol
SMILESCCNC(C)(CCO)c1cnccn1
InChIInChI=1S/C10H17N3O/c1-3-13-10(2,4-7-14)9-8-11-5-6-12-9/h5-6,8,13-14H,3-4,7H2,1-2H3
InChIKeyWPCACEQEJVARCG-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.68
Rot. Bonds5

About 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol

3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol (PubChem CID 65239954) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol.

Molecular Properties

Compound Name3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol
PubChem CID65239954
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol
SMILESCCNC(C)(CCO)c1cnccn1
InChIInChI=1S/C10H17N3O/c1-3-13-10(2,4-7-14)9-8-11-5-6-12-9/h5-6,8,13-14H,3-4,7H2,1-2H3
InChIKeyWPCACEQEJVARCG-UHFFFAOYSA-N
XLogP0.68
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol?
The IUPAC name of 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol (CID 65239954) is 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol.
What is the SMILES notation for 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol?
The canonical SMILES for 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol is CCNC(C)(CCO)c1cnccn1.
What is the InChIKey of 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol?
The InChIKey is WPCACEQEJVARCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-13-10(2,4-7-14)9-8-11-5-6-12-9/h5-6,8,13-14H,3-4,7H2,1-2H3.
What are the key properties of 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol?
3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-3-pyrazin-2-ylbutan-1-ol is sourced from PubChem (CID 65239954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).