5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine

C11H18N4 — CID 107380878

IUPAC5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine
SMILESC=CCCCN(C)c1cnc(CN)cn1
InChIInChI=1S/C11H18N4/c1-3-4-5-6-15(2)11-9-13-10(7-12)8-14-11/h3,8-9H,1,4-7,12H2,2H3
InChIKeyJQTVSTUGDJDHGI-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.34
Rot. Bonds6

About 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine

5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine (PubChem CID 107380878) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine
PubChem CID107380878
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine
SMILESC=CCCCN(C)c1cnc(CN)cn1
InChIInChI=1S/C11H18N4/c1-3-4-5-6-15(2)11-9-13-10(7-12)8-14-11/h3,8-9H,1,4-7,12H2,2H3
InChIKeyJQTVSTUGDJDHGI-UHFFFAOYSA-N
XLogP1.34
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[[5-(aminomethyl)pyrazin-2-yl]-methylamino]pentan-1-ol
CID 107198062
5-[(1S)-1-aminoethyl]-N-methyl-N-pent-4-enylpyridin-2-amine
CID 104869689
3-[[5-(aminomethyl)pyrazin-2-yl]-methylamino]-N-methylpropanamide
CID 106914421
4-(aminomethyl)-3-fluoro-N-methyl-N-pent-4-enylpyridin-2-amine
CID 105390426
(1S)-1-[5-[methyl(pent-4-enyl)amino]-2-pyridinyl]ethanol
CID 104869711
(5-but-3-enoxypyrazin-2-yl)methanamine
CID 107381324
2-[[5-(hydroxymethyl)pyrazin-2-yl]-methylamino]ethanol
CID 107372728
2-N-methyl-2-N-pentylpyrazine-2,5-diamine
CID 80653265
2-(5-amino-2-pyridinyl)-N-methyl-N-pent-4-enylacetamide
CID 107339694
N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
CID 107378904
(5-prop-2-enoxypyrazin-2-yl)methanamine
CID 107381316
5-[(5-aminopyrazin-2-yl)-methylamino]pentan-1-ol
CID 107207397

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine?
The IUPAC name of 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine (CID 107380878) is 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine?
The canonical SMILES for 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine is C=CCCCN(C)c1cnc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine?
The InChIKey is JQTVSTUGDJDHGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-3-4-5-6-15(2)11-9-13-10(7-12)8-14-11/h3,8-9H,1,4-7,12H2,2H3.
What are the key properties of 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine?
5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine has a molecular weight of 206.29 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-methyl-N-pent-4-enylpyrazin-2-amine is sourced from PubChem (CID 107380878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).