N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine

C11H17N3O — CID 103986939

IUPACN-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
SMILESCNC(CC1CCOC1)c1cnccn1
InChIInChI=1S/C11H17N3O/c1-12-10(6-9-2-5-15-8-9)11-7-13-3-4-14-11/h3-4,7,9-10,12H,2,5-6,8H2,1H3
InChIKeyFMKZRKFSBXPFLZ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.16
Rot. Bonds4

About N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine

N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine (PubChem CID 103986939) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
PubChem CID103986939
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
SMILESCNC(CC1CCOC1)c1cnccn1
InChIInChI=1S/C11H17N3O/c1-12-10(6-9-2-5-15-8-9)11-7-13-3-4-14-11/h3-4,7,9-10,12H,2,5-6,8H2,1H3
InChIKeyFMKZRKFSBXPFLZ-UHFFFAOYSA-N
XLogP1.16
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine?
The IUPAC name of N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine (CID 103986939) is N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine.
What is the SMILES notation for N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine?
The canonical SMILES for N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine is CNC(CC1CCOC1)c1cnccn1.
What is the InChIKey of N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine?
The InChIKey is FMKZRKFSBXPFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-12-10(6-9-2-5-15-8-9)11-7-13-3-4-14-11/h3-4,7,9-10,12H,2,5-6,8H2,1H3.
What are the key properties of N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine?
N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine has a molecular weight of 207.28 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine is sourced from PubChem (CID 103986939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).