5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol

C11H19N3O — CID 62848095

IUPAC5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol
SMILESCc1cnc(CNCCCCCO)cn1
InChIInChI=1S/C11H19N3O/c1-10-7-14-11(9-13-10)8-12-5-3-2-4-6-15/h7,9,12,15H,2-6,8H2,1H3
InChIKeyUPMWKLUXIFKHTK-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.04
Rot. Bonds7

About 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol

5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol (PubChem CID 62848095) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol.

Molecular Properties

Compound Name5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol
PubChem CID62848095
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol
SMILESCc1cnc(CNCCCCCO)cn1
InChIInChI=1S/C11H19N3O/c1-10-7-14-11(9-13-10)8-12-5-3-2-4-6-15/h7,9,12,15H,2-6,8H2,1H3
InChIKeyUPMWKLUXIFKHTK-UHFFFAOYSA-N
XLogP1.04
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(5-methylpyrazin-2-yl)methyl]hept-6-en-1-amine
CID 107006802
N-[(5-methylpyrazin-2-yl)methyl]-4-methylsulfanylbutan-1-amine
CID 103778202
2-fluoro-N-[(5-methylpyrazin-2-yl)methyl]ethanamine
CID 80695023
6-(pyrazin-2-ylmethylamino)hexan-1-ol
CID 103846289
N',N'-dimethyl-N-[(5-methylpyrazin-2-yl)methyl]ethane-1,2-diamine
CID 62845919
N-[(5-methylpyrazin-2-yl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 112700188
4-hydroxy-N-[(5-methylpyrazin-2-yl)methyl]butane-1-sulfonamide
CID 114134767
1-[(5-methylpyrazin-2-yl)methylamino]propan-2-ol
CID 62847369
5-[(2-methyl-1H-imidazol-5-yl)methylamino]pentan-1-ol
CID 107302918
2-[(5-methylpyrazin-2-yl)methylamino]acetonitrile
CID 62846098
1-butyl-3-[(5-methylpyrazin-2-yl)methyl]thiourea
CID 116508365
4-[[(5-methylpyrazin-2-yl)methylamino]methyl]benzoic acid
CID 62845546

Frequently Asked Questions

What is the IUPAC name of 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol?
The IUPAC name of 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol (CID 62848095) is 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol.
What is the SMILES notation for 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol?
The canonical SMILES for 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol is Cc1cnc(CNCCCCCO)cn1.
What is the InChIKey of 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol?
The InChIKey is UPMWKLUXIFKHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-10-7-14-11(9-13-10)8-12-5-3-2-4-6-15/h7,9,12,15H,2-6,8H2,1H3.
What are the key properties of 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol?
5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 1.04, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-methylpyrazin-2-yl)methylamino]pentan-1-ol is sourced from PubChem (CID 62848095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).