2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine

C15H32N2O2 — CID 82965281

IUPAC2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine
SMILESCCOCCN(CCOCC)CCC1CCCC1N
InChIInChI=1S/C15H32N2O2/c1-3-18-12-10-17(11-13-19-4-2)9-8-14-6-5-7-15(14)16/h14-15H,3-13,16H2,1-2H3
InChIKeyBZVLUZDCXCUZNT-UHFFFAOYSA-N
MW272.43 g/mol
LogP1.88
Rot. Bonds11

About 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine

2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine (PubChem CID 82965281) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine
PubChem CID82965281
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine
SMILESCCOCCN(CCOCC)CCC1CCCC1N
InChIInChI=1S/C15H32N2O2/c1-3-18-12-10-17(11-13-19-4-2)9-8-14-6-5-7-15(14)16/h14-15H,3-13,16H2,1-2H3
InChIKeyBZVLUZDCXCUZNT-UHFFFAOYSA-N
XLogP1.88
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.88
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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Frequently Asked Questions

What is the IUPAC name of 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine?
The IUPAC name of 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine (CID 82965281) is 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine is CCOCCN(CCOCC)CCC1CCCC1N.
What is the InChIKey of 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine?
The InChIKey is BZVLUZDCXCUZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-3-18-12-10-17(11-13-19-4-2)9-8-14-6-5-7-15(14)16/h14-15H,3-13,16H2,1-2H3.
What are the key properties of 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine?
2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine has a molecular weight of 272.43 g/mol, XLogP of 1.88, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[bis(2-ethoxyethyl)amino]ethyl]cyclopentan-1-amine is sourced from PubChem (CID 82965281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).