2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine

C15H29NO3 — CID 104562462

IUPAC2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCOCCOCCOCCNCC(C1CC1)C1CC1
InChIInChI=1S/C15H29NO3/c1-17-8-9-19-11-10-18-7-6-16-12-15(13-2-3-13)14-4-5-14/h13-16H,2-12H2,1H3
InChIKeyPUOOALFGVPCHDK-UHFFFAOYSA-N
MW271.40 g/mol
LogP1.69
Rot. Bonds13

About 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine

2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine (PubChem CID 104562462) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine.

Molecular Properties

Compound Name2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
PubChem CID104562462
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC Name2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCOCCOCCOCCNCC(C1CC1)C1CC1
InChIInChI=1S/C15H29NO3/c1-17-8-9-19-11-10-18-7-6-16-12-15(13-2-3-13)14-4-5-14/h13-16H,2-12H2,1H3
InChIKeyPUOOALFGVPCHDK-UHFFFAOYSA-N
XLogP1.69
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-2-cyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
CID 104567217
N-[2-(2-aminoethoxy)ethyl]-2,2-dicyclopropylethanamine
CID 79479050
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopropanamine
CID 104560665
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylbutan-1-amine
CID 104562209
1-cyclopropyl-N-[2-(2-methoxyethoxy)ethyl]-2-methylpropan-1-amine
CID 115712459
1-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-N,2-N-dimethylpropane-1,2-diamine
CID 104562097
2-methoxy-N-[2-[2-[2-[2-[2-(2-methoxyethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]ethanamine
CID 102574909
bis(1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane);2-methoxy-N-(2-methoxyethyl)ethanamine
CID 87204076
N-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-2-methylpropan-1-amine
CID 104560835
4-(2-methoxyethoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456720
2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine
CID 79707310
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
CID 103075099

Frequently Asked Questions

What is the IUPAC name of 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The IUPAC name of 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine (CID 104562462) is 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine.
What is the SMILES notation for 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The canonical SMILES for 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine is COCCOCCOCCNCC(C1CC1)C1CC1.
What is the InChIKey of 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
The InChIKey is PUOOALFGVPCHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-17-8-9-19-11-10-18-7-6-16-12-15(13-2-3-13)14-4-5-14/h13-16H,2-12H2,1H3.
What are the key properties of 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine?
2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine has a molecular weight of 271.40 g/mol, XLogP of 1.69, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine is sourced from PubChem (CID 104562462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).