4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine

C15H28N2O2 — CID 79677680

IUPAC4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine
SMILESNC1CCC(OCCN2CC3(CCOCC3)C2)CC1
InChIInChI=1S/C15H28N2O2/c16-13-1-3-14(4-2-13)19-10-7-17-11-15(12-17)5-8-18-9-6-15/h13-14H,1-12,16H2
InChIKeyFFRVWTCSMYJBIN-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.39
Rot. Bonds4

About 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine

4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine (PubChem CID 79677680) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine
PubChem CID79677680
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine
SMILESNC1CCC(OCCN2CC3(CCOCC3)C2)CC1
InChIInChI=1S/C15H28N2O2/c16-13-1-3-14(4-2-13)19-10-7-17-11-15(12-17)5-8-18-9-6-15/h13-14H,1-12,16H2
InChIKeyFFRVWTCSMYJBIN-UHFFFAOYSA-N
XLogP1.39
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine?
The IUPAC name of 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine (CID 79677680) is 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine.
What is the SMILES notation for 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine?
The canonical SMILES for 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine is NC1CCC(OCCN2CC3(CCOCC3)C2)CC1.
What is the InChIKey of 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine?
The InChIKey is FFRVWTCSMYJBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c16-13-1-3-14(4-2-13)19-10-7-17-11-15(12-17)5-8-18-9-6-15/h13-14H,1-12,16H2.
What are the key properties of 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine?
4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)ethoxy]cyclohexan-1-amine is sourced from PubChem (CID 79677680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).