N-methoxyspiro[4.5]decan-8-amine

C11H21NO — CID 114817828

IUPACN-methoxyspiro[4.5]decan-8-amine
SMILESCONC1CCC2(CCCC2)CC1
InChIInChI=1S/C11H21NO/c1-13-12-10-4-8-11(9-5-10)6-2-3-7-11/h10,12H,2-9H2,1H3
InChIKeyKWOGTMQJOQUYGU-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.64
Rot. Bonds2

About N-methoxyspiro[4.5]decan-8-amine

N-methoxyspiro[4.5]decan-8-amine (PubChem CID 114817828) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-methoxyspiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-methoxyspiro[4.5]decan-8-amine
PubChem CID114817828
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-methoxyspiro[4.5]decan-8-amine
SMILESCONC1CCC2(CCCC2)CC1
InChIInChI=1S/C11H21NO/c1-13-12-10-4-8-11(9-5-10)6-2-3-7-11/h10,12H,2-9H2,1H3
InChIKeyKWOGTMQJOQUYGU-UHFFFAOYSA-N
XLogP2.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxyspiro[4.5]decan-8-amine?
The IUPAC name of N-methoxyspiro[4.5]decan-8-amine (CID 114817828) is N-methoxyspiro[4.5]decan-8-amine.
What is the SMILES notation for N-methoxyspiro[4.5]decan-8-amine?
The canonical SMILES for N-methoxyspiro[4.5]decan-8-amine is CONC1CCC2(CCCC2)CC1.
What is the InChIKey of N-methoxyspiro[4.5]decan-8-amine?
The InChIKey is KWOGTMQJOQUYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-13-12-10-4-8-11(9-5-10)6-2-3-7-11/h10,12H,2-9H2,1H3.
What are the key properties of N-methoxyspiro[4.5]decan-8-amine?
N-methoxyspiro[4.5]decan-8-amine has a molecular weight of 183.29 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxyspiro[4.5]decan-8-amine is sourced from PubChem (CID 114817828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).