N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine

C18H34N2O — CID 114817133

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine
SMILESCC(C)(CNC1CCC2(CCCC2)CC1)N1CCOCC1
InChIInChI=1S/C18H34N2O/c1-17(2,20-11-13-21-14-12-20)15-19-16-5-9-18(10-6-16)7-3-4-8-18/h16,19H,3-15H2,1-2H3
InChIKeyQXGGJSDEOLMDPA-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.19
Rot. Bonds4

About N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine

N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine (PubChem CID 114817133) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine
PubChem CID114817133
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine
SMILESCC(C)(CNC1CCC2(CCCC2)CC1)N1CCOCC1
InChIInChI=1S/C18H34N2O/c1-17(2,20-11-13-21-14-12-20)15-19-16-5-9-18(10-6-16)7-3-4-8-18/h16,19H,3-15H2,1-2H3
InChIKeyQXGGJSDEOLMDPA-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine (CID 114817133) is N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine is CC(C)(CNC1CCC2(CCCC2)CC1)N1CCOCC1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine?
The InChIKey is QXGGJSDEOLMDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-17(2,20-11-13-21-14-12-20)15-19-16-5-9-18(10-6-16)7-3-4-8-18/h16,19H,3-15H2,1-2H3.
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine?
N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine has a molecular weight of 294.48 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)spiro[4.5]decan-8-amine is sourced from PubChem (CID 114817133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).