7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine

C18H34N2O2 — CID 158372675

IUPAC7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine
SMILESCOCCNC1CC2(CCCCC2)N(O)C2(CCCCC2)C1
InChIInChI=1S/C18H34N2O2/c1-22-13-12-19-16-14-17(8-4-2-5-9-17)20(21)18(15-16)10-6-3-7-11-18/h16,19,21H,2-15H2,1H3
InChIKeyCAKLTJCMDGZGBQ-UHFFFAOYSA-N
MW310.48 g/mol
LogP3.48
Rot. Bonds4

About 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine

7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine (PubChem CID 158372675) has the molecular formula C18H34N2O2 and a molecular weight of 310.48 g/mol. Its IUPAC name is 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine.

Molecular Properties

Compound Name7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine
PubChem CID158372675
Molecular FormulaC18H34N2O2
Molecular Weight310.48 g/mol
Exact Mass310.26
IUPAC Name7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine
SMILESCOCCNC1CC2(CCCCC2)N(O)C2(CCCCC2)C1
InChIInChI=1S/C18H34N2O2/c1-22-13-12-19-16-14-17(8-4-2-5-9-17)20(21)18(15-16)10-6-3-7-11-18/h16,19,21H,2-15H2,1H3
InChIKeyCAKLTJCMDGZGBQ-UHFFFAOYSA-N
XLogP3.48
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.48
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)cycloheptanamine
CID 22484521
(2,2-dimethylcyclopropyl)-[7-(2-methoxyethylamino)-5-thia-2-azaspiro[3.4]octan-2-yl]methanone
CID 155877921
N'-cycloheptyl-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62573665
1-[4-(butylamino)-2,2,6,6-tetramethylpiperidin-1-yl]oxycyclohexan-1-ol
CID 174411658
2-(2-azaspiro[3.6]decan-2-yl)-N-(2-methoxyethyl)ethanamine
CID 83030393
N-(2-methoxyethyl)-4-methylcycloheptan-1-amine
CID 65081207
2-methoxy-N-(spiro[3.3]heptan-2-ylmethyl)ethanamine
CID 65009357
1-tert-butyl-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 51039629
(1S,2S,4R)-N-(2-methoxyethyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 124572600
1-(2-methoxyethylamino)cyclohexane-1-carboxylic acid
CID 61340492
N-(2-methoxyethyl)thian-4-amine;hydrochloride
CID 86811713
N-(2-methoxyethyl)oxan-4-amine;hydrochloride
CID 110204327

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine?
The IUPAC name of 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine (CID 158372675) is 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine.
What is the SMILES notation for 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine?
The canonical SMILES for 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine is COCCNC1CC2(CCCCC2)N(O)C2(CCCCC2)C1.
What is the InChIKey of 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine?
The InChIKey is CAKLTJCMDGZGBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O2/c1-22-13-12-19-16-14-17(8-4-2-5-9-17)20(21)18(15-16)10-6-3-7-11-18/h16,19,21H,2-15H2,1H3.
What are the key properties of 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine?
7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine has a molecular weight of 310.48 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-N-(2-methoxyethyl)-7-azadispiro[5.1.58.36]hexadecan-15-amine is sourced from PubChem (CID 158372675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).