N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine

C11H25NO2 — CID 156523770

IUPACN-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine
SMILESCNCCCOCCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-11(2)10-14-9-5-8-13-7-4-6-12-3/h11-12H,4-10H2,1-3H3
InChIKeyBNFUSJZNSJEPEZ-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.68
Rot. Bonds10

About N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine

N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine (PubChem CID 156523770) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine
PubChem CID156523770
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC NameN-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine
SMILESCNCCCOCCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-11(2)10-14-9-5-8-13-7-4-6-12-3/h11-12H,4-10H2,1-3H3
InChIKeyBNFUSJZNSJEPEZ-UHFFFAOYSA-N
XLogP1.68
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-1-[3-(2-methylpropoxy)propoxy]propane
CID 22020669
ethane;N-methyl-2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethanamine;molecular hydrogen
CID 166117976
6-methyl-1-[3-(2-methylpropoxy)propoxy]heptane
CID 171593627
3-methyl-1-[3-(2-methylpropoxy)propoxy]butane
CID 171414218
N,6-dimethyl-1-(2-methylpropoxy)heptan-4-amine
CID 106454538
N-[2-(2-methylpropoxy)ethyl]-3-propoxypropan-1-amine
CID 106452398
2-(methylamino)-N-[3-(2-methylpropoxy)propyl]acetamide;hydrochloride
CID 119693610
ethane;3-[3-(2-methoxyethoxy)propoxy]-N-methylpropan-1-amine
CID 176551886
N-[3-(2-methylpropoxy)propyl]pentan-3-amine
CID 28681675
7-methyl-1-(2-methylpropoxy)octane
CID 23222552
6-methyl-1-(2-methylpropoxy)heptane
CID 58371735
2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
CID 60714986

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine?
The IUPAC name of N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine (CID 156523770) is N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine.
What is the SMILES notation for N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine?
The canonical SMILES for N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine is CNCCCOCCCOCC(C)C.
What is the InChIKey of N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine?
The InChIKey is BNFUSJZNSJEPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-11(2)10-14-9-5-8-13-7-4-6-12-3/h11-12H,4-10H2,1-3H3.
What are the key properties of N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine?
N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 1.68, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[3-(2-methylpropoxy)propoxy]propan-1-amine is sourced from PubChem (CID 156523770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).