N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine

C14H25NO2 — CID 79894716

IUPACN-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine
SMILESCNCC1CC(OC2CCOC3(CCC3)C2)C1
InChIInChI=1S/C14H25NO2/c1-15-10-11-7-13(8-11)17-12-3-6-16-14(9-12)4-2-5-14/h11-13,15H,2-10H2,1H3
InChIKeyHVVZNOBOAZBCCO-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.10
Rot. Bonds4

About N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine

N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine (PubChem CID 79894716) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine
PubChem CID79894716
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine
SMILESCNCC1CC(OC2CCOC3(CCC3)C2)C1
InChIInChI=1S/C14H25NO2/c1-15-10-11-7-13(8-11)17-12-3-6-16-14(9-12)4-2-5-14/h11-13,15H,2-10H2,1H3
InChIKeyHVVZNOBOAZBCCO-UHFFFAOYSA-N
XLogP2.10
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(5-oxaspiro[3.5]nonan-8-yloxy)propan-1-amine
CID 79894166
3-(5-oxaspiro[3.5]nonan-8-yloxy)pyrrolidine
CID 79894162
N-(5-oxaspiro[3.5]nonan-8-ylmethyl)propan-2-amine
CID 79914114
N-(6-oxaspiro[4.5]decan-9-ylmethyl)ethanamine
CID 79914759
5-oxaspiro[3.5]nonan-8-yl 1-oxopropane-1-sulfinate
CID 163437609
N-methyl-1-[1-(6-oxaspiro[4.5]decan-9-yl)piperidin-3-yl]methanamine
CID 79900888
2-methyl-N-(6-oxaspiro[4.5]decan-9-ylmethyl)propan-1-amine
CID 79914861
N-[[4-(6-oxaspiro[4.5]decan-9-yloxy)phenyl]methyl]ethanamine
CID 79899819
2-(5-oxaspiro[3.5]nonan-8-yloxy)ethanamine
CID 79893869
[(8R)-5-oxaspiro[3.5]nonan-8-yl] methanesulfonate
CID 96581378
N-methyl-1-[3-methyl-2-(5-oxaspiro[3.5]nonan-8-yloxy)phenyl]methanamine
CID 115952194
O-(1-oxaspiro[5.5]undecan-4-yl)hydroxylamine
CID 79894176

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine?
The IUPAC name of N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine (CID 79894716) is N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine?
The canonical SMILES for N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine is CNCC1CC(OC2CCOC3(CCC3)C2)C1.
What is the InChIKey of N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine?
The InChIKey is HVVZNOBOAZBCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-15-10-11-7-13(8-11)17-12-3-6-16-14(9-12)4-2-5-14/h11-13,15H,2-10H2,1H3.
What are the key properties of N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine?
N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine has a molecular weight of 239.36 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-(5-oxaspiro[3.5]nonan-8-yloxy)cyclobutyl]methanamine is sourced from PubChem (CID 79894716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).