N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine

C15H30N2O — CID 79898315

IUPACN',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCOC2(CCCC2)C1
InChIInChI=1S/C15H30N2O/c1-3-17(4-2)11-10-16-14-7-12-18-15(13-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3
InChIKeyJLPHBKCVCAWREB-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.41
Rot. Bonds6

About N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine

N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine (PubChem CID 79898315) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine
PubChem CID79898315
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCOC2(CCCC2)C1
InChIInChI=1S/C15H30N2O/c1-3-17(4-2)11-10-16-14-7-12-18-15(13-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3
InChIKeyJLPHBKCVCAWREB-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,9-dioxaspiro[5.5]undecan-4-yl)-N',N'-diethylethane-1,2-diamine
CID 79898387
N-(1-oxaspiro[5.5]undecan-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 79901598
N'-methyl-N-(6-oxaspiro[4.5]decan-9-yl)-N'-propan-2-ylethane-1,2-diamine
CID 79903260
N-butyl-1-oxaspiro[5.5]undecan-4-amine
CID 79897622
N'-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diamine
CID 79895111
N'-methyl-N-(1-oxaspiro[5.5]undecan-4-yl)-N'-propan-2-ylbutane-1,4-diamine
CID 79899327
9-methyl-N-propyl-1-oxaspiro[5.6]dodecan-4-amine
CID 65082535
N-(2-butoxyethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895357
N-(3-propoxypropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 82941325
N-(1,9-dioxaspiro[5.5]undecan-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 79901356
N-(2-methylprop-2-enyl)-6-oxaspiro[4.5]decan-9-amine
CID 114616860
N-[(1-methylcyclopentyl)methyl]-1-oxaspiro[5.5]undecan-4-amine
CID 79903273

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine (CID 79898315) is N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine is CCN(CC)CCNC1CCOC2(CCCC2)C1.
What is the InChIKey of N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine?
The InChIKey is JLPHBKCVCAWREB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-17(4-2)11-10-16-14-7-12-18-15(13-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3.
What are the key properties of N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine has a molecular weight of 254.42 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(6-oxaspiro[4.5]decan-9-yl)ethane-1,2-diamine is sourced from PubChem (CID 79898315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).