N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine

C15H27NO3 — CID 79895178

IUPACN-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine
SMILESCOC1CCCC1NC1CCOC2(CCOCC2)C1
InChIInChI=1S/C15H27NO3/c1-17-14-4-2-3-13(14)16-12-5-8-19-15(11-12)6-9-18-10-7-15/h12-14,16H,2-11H2,1H3
InChIKeyLJHYZBJYSSUZRU-UHFFFAOYSA-N
MW269.38 g/mol
LogP1.87
Rot. Bonds3

About N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine

N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine (PubChem CID 79895178) has the molecular formula C15H27NO3 and a molecular weight of 269.38 g/mol. Its IUPAC name is N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine.

Molecular Properties

Compound NameN-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine
PubChem CID79895178
Molecular FormulaC15H27NO3
Molecular Weight269.38 g/mol
Exact Mass269.20
IUPAC NameN-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine
SMILESCOC1CCCC1NC1CCOC2(CCOCC2)C1
InChIInChI=1S/C15H27NO3/c1-17-14-4-2-3-13(14)16-12-5-8-19-15(11-12)6-9-18-10-7-15/h12-14,16H,2-11H2,1H3
InChIKeyLJHYZBJYSSUZRU-UHFFFAOYSA-N
XLogP1.87
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79897682
N-cycloheptyl-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79897814
N-(2-methoxycyclohexyl)oxolan-3-amine
CID 80717087
N-(2,2,3,3-tetramethylcyclopropyl)-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79903159
N-(2,3-dimethylcyclohexyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79897645
N-(2-methylsulfanylcyclohexyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 103907294
N-(1,9-dioxaspiro[5.5]undecan-4-yl)-1,3-dimethylpiperidin-4-amine
CID 115894817
N-(1-methylcyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine
CID 79895145
N-(2,3-dimethylcyclopentyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79903372
N-(2-methoxycyclopentyl)-3,3,5,5-tetramethylcyclohexan-1-amine
CID 112682082
N-(2-methoxycyclopentyl)cyclododecanamine
CID 63477774
2-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-methylcycloheptan-1-amine
CID 79919575

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine?
The IUPAC name of N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine (CID 79895178) is N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine.
What is the SMILES notation for N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine?
The canonical SMILES for N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine is COC1CCCC1NC1CCOC2(CCOCC2)C1.
What is the InChIKey of N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine?
The InChIKey is LJHYZBJYSSUZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO3/c1-17-14-4-2-3-13(14)16-12-5-8-19-15(11-12)6-9-18-10-7-15/h12-14,16H,2-11H2,1H3.
What are the key properties of N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine?
N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine has a molecular weight of 269.38 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxycyclopentyl)-1,9-dioxaspiro[5.5]undecan-4-amine is sourced from PubChem (CID 79895178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).