1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine

C10H21NO2 — CID 103184766

IUPAC1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine
SMILESCOCCCOCCC1(N)CCC1
InChIInChI=1S/C10H21NO2/c1-12-7-3-8-13-9-6-10(11)4-2-5-10/h2-9,11H2,1H3
InChIKeyMQUQLWHDSVHTMU-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.31
Rot. Bonds7

About 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine

1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine (PubChem CID 103184766) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine.

Molecular Properties

Compound Name1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine
PubChem CID103184766
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine
SMILESCOCCCOCCC1(N)CCC1
InChIInChI=1S/C10H21NO2/c1-12-7-3-8-13-9-6-10(11)4-2-5-10/h2-9,11H2,1H3
InChIKeyMQUQLWHDSVHTMU-UHFFFAOYSA-N
XLogP1.31
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.31
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

1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cycloheptan-1-amine
CID 104568568
1-(bromomethyl)-1-[2-(3-methoxypropoxy)ethyl]cyclobutane
CID 103185009
[2-[2-(3-methoxypropoxy)ethyl]thiolan-2-yl]methanamine
CID 103184863
1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclobutan-1-amine
CID 79841843
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
1-[2-(2-methylpropoxy)ethyl]cyclobutan-1-amine
CID 106459234
1-[2-[bis(2-methoxyethyl)amino]ethyl]cyclobutan-1-amine
CID 79843376
1-[2-(3-methoxypropoxy)ethyl]cyclopentane-1-carboxylic acid
CID 103181465
1-[2-[2-methoxyethyl(methyl)amino]ethyl]cyclobutan-1-amine
CID 79844292
1-(2-butoxyethyl)-4-methylcyclohexan-1-amine
CID 62620295
1-[1-[2-(3-methoxypropoxy)ethyl]cyclopropyl]ethanone
CID 106797314
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxymethyl]cyclohexan-1-amine
CID 104564416

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine?
The IUPAC name of 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine (CID 103184766) is 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine.
What is the SMILES notation for 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine?
The canonical SMILES for 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine is COCCCOCCC1(N)CCC1.
What is the InChIKey of 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine?
The InChIKey is MQUQLWHDSVHTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-12-7-3-8-13-9-6-10(11)4-2-5-10/h2-9,11H2,1H3.
What are the key properties of 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine?
1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine has a molecular weight of 187.28 g/mol, XLogP of 1.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine is sourced from PubChem (CID 103184766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).