2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine

C17H34N2O — CID 79912220

IUPAC2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine
SMILESCCN(CC)C(C)(C)C(NC)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H34N2O/c1-6-19(7-2)16(3,4)15(18-5)14-9-12-20-17(13-14)10-8-11-17/h14-15,18H,6-13H2,1-5H3
InChIKeyPADGDFUMUDSXLM-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.04
Rot. Bonds6

About 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine

2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine (PubChem CID 79912220) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine
PubChem CID79912220
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine
SMILESCCN(CC)C(C)(C)C(NC)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H34N2O/c1-6-19(7-2)16(3,4)15(18-5)14-9-12-20-17(13-14)10-8-11-17/h14-15,18H,6-13H2,1-5H3
InChIKeyPADGDFUMUDSXLM-UHFFFAOYSA-N
XLogP3.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine with MolForge

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Related Compounds

1-N,2-N,2-N-triethyl-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine
CID 79906946
[2,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)butyl]hydrazine
CID 105322295
1-hydrazinyl-N,N,2-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-2-amine
CID 105239137
2-ethoxy-N,3,3-trimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-amine
CID 116725429
[2-ethoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propyl]hydrazine
CID 105274254
[2,2-dimethyl-1-(6-oxaspiro[4.5]decan-9-yl)butyl]hydrazine
CID 105325523
N,3,4,4-tetramethyl-1-(5-oxaspiro[3.5]nonan-8-yl)pentan-1-amine
CID 105010327
N-ethyl-2,2,2-trifluoro-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 105016756
[2-ethoxy-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propyl]hydrazine
CID 105274222
N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-amine
CID 79915589
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N,2,2-trimethylpropan-1-amine
CID 79914724
1-(4-ethylcyclohexyl)-N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79912030

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine?
The IUPAC name of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine (CID 79912220) is 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine?
The canonical SMILES for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine is CCN(CC)C(C)(C)C(NC)C1CCOC2(CCC2)C1.
What is the InChIKey of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine?
The InChIKey is PADGDFUMUDSXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-6-19(7-2)16(3,4)15(18-5)14-9-12-20-17(13-14)10-8-11-17/h14-15,18H,6-13H2,1-5H3.
What are the key properties of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine?
2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine has a molecular weight of 282.47 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)propane-1,2-diamine is sourced from PubChem (CID 79912220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).