2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine

C12H27NO — CID 71361648

IUPAC2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine
SMILESCCCC(CCC)(COC)CN(C)C
InChIInChI=1S/C12H27NO/c1-6-8-12(9-7-2,11-14-5)10-13(3)4/h6-11H2,1-5H3
InChIKeyGPKWFBQOCQDGCY-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.78
Rot. Bonds8

About 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine

2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine (PubChem CID 71361648) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine
PubChem CID71361648
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine
SMILESCCCC(CCC)(COC)CN(C)C
InChIInChI=1S/C12H27NO/c1-6-8-12(9-7-2,11-14-5)10-13(3)4/h6-11H2,1-5H3
InChIKeyGPKWFBQOCQDGCY-UHFFFAOYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine?
The IUPAC name of 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine (CID 71361648) is 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine is CCCC(CCC)(COC)CN(C)C.
What is the InChIKey of 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine?
The InChIKey is GPKWFBQOCQDGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-6-8-12(9-7-2,11-14-5)10-13(3)4/h6-11H2,1-5H3.
What are the key properties of 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine?
2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine has a molecular weight of 201.35 g/mol, XLogP of 2.78, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine is sourced from PubChem (CID 71361648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).