N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine

C14H25NO — CID 79895616

IUPACN-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
SMILESC1CCC2(CC1)CC(NC1CCC1)CCO2
InChIInChI=1S/C14H25NO/c1-2-8-14(9-3-1)11-13(7-10-16-14)15-12-5-4-6-12/h12-13,15H,1-11H2
InChIKeySRDYYFGGWCECDI-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.01
Rot. Bonds2

About N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine

N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine (PubChem CID 79895616) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine.

Molecular Properties

Compound NameN-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
PubChem CID79895616
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
SMILESC1CCC2(CC1)CC(NC1CCC1)CCO2
InChIInChI=1S/C14H25NO/c1-2-8-14(9-3-1)11-13(7-10-16-14)15-12-5-4-6-12/h12-13,15H,1-11H2
InChIKeySRDYYFGGWCECDI-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-cyclohexyl-1-oxaspiro[5.5]undecan-4-amine
CID 79898516
N-cycloheptyl-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79897814
N-(1,1-dioxothian-4-yl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895341
N-(thian-3-yl)-1-oxaspiro[5.5]undecan-4-amine
CID 86811515
N-(oxan-3-yl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903513
N-cyclohexyl-6-oxa-2-thiaspiro[4.5]decan-9-amine
CID 79898216
N-cyclopropyl-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79897682
N-(2,3-dimethylcyclohexyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79897645
N-(1-methylcyclopentyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895290
N-(2,2-dimethylcyclohexyl)-6-oxaspiro[4.5]decan-9-amine
CID 79903322
N-(2-ethylcyclopropyl)-1-oxaspiro[5.5]undecan-4-amine
CID 114108180
N-(4-propylcyclohexyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895018

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine?
The IUPAC name of N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine (CID 79895616) is N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine.
What is the SMILES notation for N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine?
The canonical SMILES for N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine is C1CCC2(CC1)CC(NC1CCC1)CCO2.
What is the InChIKey of N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine?
The InChIKey is SRDYYFGGWCECDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-8-14(9-3-1)11-13(7-10-16-14)15-12-5-4-6-12/h12-13,15H,1-11H2.
What are the key properties of N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine?
N-cyclobutyl-1-oxaspiro[5.5]undecan-4-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-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine is sourced from PubChem (CID 79895616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).