N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine

C14H25NO — CID 79895072

IUPACN-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
SMILESCC1(NC2CCOC3(CCC3)C2)CCCC1
InChIInChI=1S/C14H25NO/c1-13(6-2-3-7-13)15-12-5-10-16-14(11-12)8-4-9-14/h12,15H,2-11H2,1H3
InChIKeyXNBLOYYKDUHYLY-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.01
Rot. Bonds2

About N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine

N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine (PubChem CID 79895072) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
PubChem CID79895072
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
SMILESCC1(NC2CCOC3(CCC3)C2)CCCC1
InChIInChI=1S/C14H25NO/c1-13(6-2-3-7-13)15-12-5-10-16-14(11-12)8-4-9-14/h12,15H,2-11H2,1H3
InChIKeyXNBLOYYKDUHYLY-UHFFFAOYSA-N
XLogP3.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methylcyclopentyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895290
N-(1-methylcyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79895145
N-(1-ethylcyclobutyl)-1-oxaspiro[5.5]undecan-4-amine
CID 113488726
N-[(1-methylcyclopentyl)methyl]-1-oxaspiro[5.5]undecan-4-amine
CID 79903273
N-(1-oxaspiro[5.5]undecan-4-yl)acetamide
CID 51358556
N-(1-methylcyclopentyl)oxolan-3-amine
CID 63335043
N-(1-methylcyclopentyl)oxan-4-amine
CID 61365399
N-[(1-methylcyclopropyl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 107166629
N-(2,2-dimethylcyclohexyl)-6-oxaspiro[4.5]decan-9-amine
CID 79903322
N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
CID 79895616
N-cyclohexyl-1-oxaspiro[5.5]undecan-4-amine
CID 79898516
N-(2-methylpropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898518

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine?
The IUPAC name of N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine (CID 79895072) is N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine.
What is the SMILES notation for N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine?
The canonical SMILES for N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine is CC1(NC2CCOC3(CCC3)C2)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine?
The InChIKey is XNBLOYYKDUHYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-13(6-2-3-7-13)15-12-5-10-16-14(11-12)8-4-9-14/h12,15H,2-11H2,1H3.
What are the key properties of N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine?
N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine has a molecular weight of 223.36 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine is sourced from PubChem (CID 79895072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).