[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol

C18H33NO2 — CID 103966384

IUPAC[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol
SMILESOCC1(CNC2CCOC3(CCCCC3)C2)CCCCC1
InChIInChI=1S/C18H33NO2/c20-15-17(8-3-1-4-9-17)14-19-16-7-12-21-18(13-16)10-5-2-6-11-18/h16,19-20H,1-15H2
InChIKeyQGPIPRGYXDNWIX-UHFFFAOYSA-N
MW295.47 g/mol
LogP3.40
Rot. Bonds4

About [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol

[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol (PubChem CID 103966384) has the molecular formula C18H33NO2 and a molecular weight of 295.47 g/mol. Its IUPAC name is [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol
PubChem CID103966384
Molecular FormulaC18H33NO2
Molecular Weight295.47 g/mol
Exact Mass295.25
IUPAC Name[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol
SMILESOCC1(CNC2CCOC3(CCCCC3)C2)CCCCC1
InChIInChI=1S/C18H33NO2/c20-15-17(8-3-1-4-9-17)14-19-16-7-12-21-18(13-16)10-5-2-6-11-18/h16,19-20H,1-15H2
InChIKeyQGPIPRGYXDNWIX-UHFFFAOYSA-N
XLogP3.40
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[(5-oxaspiro[3.5]nonan-8-ylamino)methyl]cyclohexyl]methanol
CID 103966489
[1-[(2,6-dioxaspiro[4.5]decan-9-ylamino)methyl]cyclopentyl]methanol
CID 115359651
N-[(1-methylcyclopentyl)methyl]-1-oxaspiro[5.5]undecan-4-amine
CID 79903273
[4-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]phenyl]methanol
CID 107230893
4-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]oxan-4-ol
CID 81130792
2,2-difluoro-3-(1-oxaspiro[5.5]undecan-4-ylamino)propan-1-ol
CID 106176373
N-[(1-methylcyclopropyl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 107166629
N-(2-methylprop-2-enyl)-6-oxaspiro[4.5]decan-9-amine
CID 114616860
[1-[[(3,3-dimethylcyclohexyl)amino]methyl]cyclohexyl]methanol
CID 81435372
N-butyl-1-oxaspiro[5.5]undecan-4-amine
CID 79897622
N-(oxolan-3-ylmethyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895785
N-(3-methyl-2-propan-2-ylbutyl)-1-oxaspiro[5.5]undecan-4-amine
CID 102905388

Frequently Asked Questions

What is the IUPAC name of [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol?
The IUPAC name of [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol (CID 103966384) is [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol is OCC1(CNC2CCOC3(CCCCC3)C2)CCCCC1.
What is the InChIKey of [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol?
The InChIKey is QGPIPRGYXDNWIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33NO2/c20-15-17(8-3-1-4-9-17)14-19-16-7-12-21-18(13-16)10-5-2-6-11-18/h16,19-20H,1-15H2.
What are the key properties of [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol?
[1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol has a molecular weight of 295.47 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-oxaspiro[5.5]undecan-4-ylamino)methyl]cyclohexyl]methanol is sourced from PubChem (CID 103966384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).