(3-pentoxypyrazin-2-yl)methanamine

C10H17N3O — CID 62672198

IUPAC(3-pentoxypyrazin-2-yl)methanamine
SMILESCCCCCOc1nccnc1CN
InChIInChI=1S/C10H17N3O/c1-2-3-4-7-14-10-9(8-11)12-5-6-13-10/h5-6H,2-4,7-8,11H2,1H3
InChIKeyLVFCSEISYBVPLK-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.50
Rot. Bonds6

About (3-pentoxypyrazin-2-yl)methanamine

(3-pentoxypyrazin-2-yl)methanamine (PubChem CID 62672198) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is (3-pentoxypyrazin-2-yl)methanamine.

Molecular Properties

Compound Name(3-pentoxypyrazin-2-yl)methanamine
PubChem CID62672198
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name(3-pentoxypyrazin-2-yl)methanamine
SMILESCCCCCOc1nccnc1CN
InChIInChI=1S/C10H17N3O/c1-2-3-4-7-14-10-9(8-11)12-5-6-13-10/h5-6H,2-4,7-8,11H2,1H3
InChIKeyLVFCSEISYBVPLK-UHFFFAOYSA-N
XLogP1.50
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[3-[2-(2-methylpropoxy)ethoxy]pyrazin-2-yl]methanamine
CID 106446703
[3-(3-phenylpropoxy)pyrazin-2-yl]methanamine
CID 62684504
2-(4-azidobutoxy)-3-decylpyrazine
CID 10616667
2-decyl-3-methoxypyrazine
CID 528301
2-hexoxypyridine-3-sulfonamide
CID 112572977
(3-hexoxy-5,6-dimethylpyridazin-4-yl)methanamine
CID 61097427
2,3-didecoxypyridine
CID 151922374
3-propoxypyrazin-2-amine
CID 102987993
4-pentoxypyridine
CID 23560340
(2-octoxy-3-pyridinyl)boronic acid
CID 57324718
[3-(3,5-dimethylcyclohexyl)oxypyrazin-2-yl]methanamine
CID 64729563
2-pentoxypyridine-3-carbaldehyde
CID 11622489

Frequently Asked Questions

What is the IUPAC name of (3-pentoxypyrazin-2-yl)methanamine?
The IUPAC name of (3-pentoxypyrazin-2-yl)methanamine (CID 62672198) is (3-pentoxypyrazin-2-yl)methanamine.
What is the SMILES notation for (3-pentoxypyrazin-2-yl)methanamine?
The canonical SMILES for (3-pentoxypyrazin-2-yl)methanamine is CCCCCOc1nccnc1CN.
What is the InChIKey of (3-pentoxypyrazin-2-yl)methanamine?
The InChIKey is LVFCSEISYBVPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-3-4-7-14-10-9(8-11)12-5-6-13-10/h5-6H,2-4,7-8,11H2,1H3.
What are the key properties of (3-pentoxypyrazin-2-yl)methanamine?
(3-pentoxypyrazin-2-yl)methanamine has a molecular weight of 195.27 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-pentoxypyrazin-2-yl)methanamine is sourced from PubChem (CID 62672198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).