N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine

C14H29NO4 — CID 103075099

IUPACN-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
SMILESCOCCOCCOCCOCC(C)CNC1CC1
InChIInChI=1S/C14H29NO4/c1-13(11-15-14-3-4-14)12-19-10-9-18-8-7-17-6-5-16-2/h13-15H,3-12H2,1-2H3
InChIKeyOKIXBVGITFNEOL-UHFFFAOYSA-N
MW275.39 g/mol
LogP1.07
Rot. Bonds14

About N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine

N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine (PubChem CID 103075099) has the molecular formula C14H29NO4 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
PubChem CID103075099
Molecular FormulaC14H29NO4
Molecular Weight275.39 g/mol
Exact Mass275.21
IUPAC NameN-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
SMILESCOCCOCCOCCOCC(C)CNC1CC1
InChIInChI=1S/C14H29NO4/c1-13(11-15-14-3-4-14)12-19-10-9-18-8-7-17-6-5-16-2/h13-15H,3-12H2,1-2H3
InChIKeyOKIXBVGITFNEOL-UHFFFAOYSA-N
XLogP1.07
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-methoxyethoxy)ethoxy]-3-methylbutyl]cyclopropanamine
CID 113427443
N-(2-methyl-3-pent-4-enoxypropyl)cyclopropanamine
CID 103074881
N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine
CID 103284483
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopropanamine
CID 104560665
N-[2-[3-(2-methoxyethoxy)propyl]-4-methylpentyl]cyclopropanamine
CID 103412314
N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
CID 103412730
1-methoxy-8-[3-[5-(2-methoxyethoxy)pentoxy]-2-methylpropoxy]octane
CID 129036094
1-(cyclopropylamino)-3-methoxypropan-2-ol
CID 21034992
3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol
CID 116501365
N-[3-(1-ethoxypropan-2-yloxy)-2-methylpropyl]cyclopropanamine
CID 103489367
1-chloro-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropane
CID 104561148
N-[2-[2-(2-methylpropoxy)ethoxy]butyl]cyclopropanamine
CID 106449904

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine?
The IUPAC name of N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine (CID 103075099) is N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine.
What is the SMILES notation for N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine?
The canonical SMILES for N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine is COCCOCCOCCOCC(C)CNC1CC1.
What is the InChIKey of N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine?
The InChIKey is OKIXBVGITFNEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO4/c1-13(11-15-14-3-4-14)12-19-10-9-18-8-7-17-6-5-16-2/h13-15H,3-12H2,1-2H3.
What are the key properties of N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine?
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine has a molecular weight of 275.39 g/mol, XLogP of 1.07, 14 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine is sourced from PubChem (CID 103075099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).