2-methyl-N-(2-methylpropoxy)propan-1-amine

C8H19NO — CID 22415895

IUPAC2-methyl-N-(2-methylpropoxy)propan-1-amine
SMILESCC(C)CNOCC(C)C
InChIInChI=1S/C8H19NO/c1-7(2)5-9-10-6-8(3)4/h7-9H,5-6H2,1-4H3
InChIKeyBQYYHSXDYQHRQM-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.82
Rot. Bonds5

About 2-methyl-N-(2-methylpropoxy)propan-1-amine

2-methyl-N-(2-methylpropoxy)propan-1-amine (PubChem CID 22415895) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropoxy)propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropoxy)propan-1-amine
PubChem CID22415895
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-methyl-N-(2-methylpropoxy)propan-1-amine
SMILESCC(C)CNOCC(C)C
InChIInChI=1S/C8H19NO/c1-7(2)5-9-10-6-8(3)4/h7-9H,5-6H2,1-4H3
InChIKeyBQYYHSXDYQHRQM-UHFFFAOYSA-N
XLogP1.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropoxy)propan-1-amine?
The IUPAC name of 2-methyl-N-(2-methylpropoxy)propan-1-amine (CID 22415895) is 2-methyl-N-(2-methylpropoxy)propan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-methylpropoxy)propan-1-amine?
The canonical SMILES for 2-methyl-N-(2-methylpropoxy)propan-1-amine is CC(C)CNOCC(C)C.
What is the InChIKey of 2-methyl-N-(2-methylpropoxy)propan-1-amine?
The InChIKey is BQYYHSXDYQHRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(2)5-9-10-6-8(3)4/h7-9H,5-6H2,1-4H3.
What are the key properties of 2-methyl-N-(2-methylpropoxy)propan-1-amine?
2-methyl-N-(2-methylpropoxy)propan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropoxy)propan-1-amine is sourced from PubChem (CID 22415895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).