2-methoxy-N,2-dimethylheptan-4-amine

C10H23NO — CID 103024818

IUPAC2-methoxy-N,2-dimethylheptan-4-amine
SMILESCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C10H23NO/c1-6-7-9(11-4)8-10(2,3)12-5/h9,11H,6-8H2,1-5H3
InChIKeyKUUYBWLLJOVAFF-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.19
Rot. Bonds6

About 2-methoxy-N,2-dimethylheptan-4-amine

2-methoxy-N,2-dimethylheptan-4-amine (PubChem CID 103024818) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-methoxy-N,2-dimethylheptan-4-amine.

Molecular Properties

Compound Name2-methoxy-N,2-dimethylheptan-4-amine
PubChem CID103024818
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-methoxy-N,2-dimethylheptan-4-amine
SMILESCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C10H23NO/c1-6-7-9(11-4)8-10(2,3)12-5/h9,11H,6-8H2,1-5H3
InChIKeyKUUYBWLLJOVAFF-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,2-dimethylheptan-4-amine?
The IUPAC name of 2-methoxy-N,2-dimethylheptan-4-amine (CID 103024818) is 2-methoxy-N,2-dimethylheptan-4-amine.
What is the SMILES notation for 2-methoxy-N,2-dimethylheptan-4-amine?
The canonical SMILES for 2-methoxy-N,2-dimethylheptan-4-amine is CCCC(CC(C)(C)OC)NC.
What is the InChIKey of 2-methoxy-N,2-dimethylheptan-4-amine?
The InChIKey is KUUYBWLLJOVAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-6-7-9(11-4)8-10(2,3)12-5/h9,11H,6-8H2,1-5H3.
What are the key properties of 2-methoxy-N,2-dimethylheptan-4-amine?
2-methoxy-N,2-dimethylheptan-4-amine has a molecular weight of 173.30 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,2-dimethylheptan-4-amine is sourced from PubChem (CID 103024818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).