5-methoxy-N,N-dimethylpentan-1-amine

C8H19NO — CID 13115259

IUPAC5-methoxy-N,N-dimethylpentan-1-amine
SMILESCOCCCCCN(C)C
InChIInChI=1S/C8H19NO/c1-9(2)7-5-4-6-8-10-3/h4-8H2,1-3H3
InChIKeyPTHCVFHIGCRFKF-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.36
Rot. Bonds6

About 5-methoxy-N,N-dimethylpentan-1-amine

5-methoxy-N,N-dimethylpentan-1-amine (PubChem CID 13115259) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 5-methoxy-N,N-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-methoxy-N,N-dimethylpentan-1-amine
PubChem CID13115259
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name5-methoxy-N,N-dimethylpentan-1-amine
SMILESCOCCCCCN(C)C
InChIInChI=1S/C8H19NO/c1-9(2)7-5-4-6-8-10-3/h4-8H2,1-3H3
InChIKeyPTHCVFHIGCRFKF-UHFFFAOYSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N,N-dimethylpentan-1-amine?
The IUPAC name of 5-methoxy-N,N-dimethylpentan-1-amine (CID 13115259) is 5-methoxy-N,N-dimethylpentan-1-amine.
What is the SMILES notation for 5-methoxy-N,N-dimethylpentan-1-amine?
The canonical SMILES for 5-methoxy-N,N-dimethylpentan-1-amine is COCCCCCN(C)C.
What is the InChIKey of 5-methoxy-N,N-dimethylpentan-1-amine?
The InChIKey is PTHCVFHIGCRFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-9(2)7-5-4-6-8-10-3/h4-8H2,1-3H3.
What are the key properties of 5-methoxy-N,N-dimethylpentan-1-amine?
5-methoxy-N,N-dimethylpentan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 1.36, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N,N-dimethylpentan-1-amine is sourced from PubChem (CID 13115259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).