3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol

C15H27NO2 — CID 106129503

IUPAC3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2CCOC3(CCCC3)C2)C1
InChIInChI=1S/C15H27NO2/c17-14-4-3-12(9-14)11-16-13-5-8-18-15(10-13)6-1-2-7-15/h12-14,16-17H,1-11H2
InChIKeyCQISHERWWSBSPW-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.23
Rot. Bonds3

About 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol

3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol (PubChem CID 106129503) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol
PubChem CID106129503
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2CCOC3(CCCC3)C2)C1
InChIInChI=1S/C15H27NO2/c17-14-4-3-12(9-14)11-16-13-5-8-18-15(10-13)6-1-2-7-15/h12-14,16-17H,1-11H2
InChIKeyCQISHERWWSBSPW-UHFFFAOYSA-N
XLogP2.23
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol 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

3-[(5-oxaspiro[3.5]nonan-8-ylamino)methyl]cyclopentan-1-ol
CID 106130055
4-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclohexan-1-ol
CID 106133298
3-[(1-oxa-9-thiaspiro[5.5]undecan-4-ylamino)methyl]cyclopentan-1-ol
CID 106129756
N-[(4-methylcyclohexyl)methyl]-6-oxaspiro[4.5]decan-9-amine
CID 79903426
N-[(3-methylcyclohexyl)methyl]-6-oxaspiro[4.5]decan-9-amine
CID 103883996
N-[(3-methylcyclohexyl)methyl]-1-oxaspiro[5.5]undecan-4-amine
CID 103883997
N-(oxolan-3-ylmethyl)-6-oxaspiro[4.5]decan-9-amine
CID 79895641
N-(oxolan-3-ylmethyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895785
N-(oxan-4-ylmethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903433
(9S)-N-[[(2R)-oxolan-2-yl]methyl]-6-oxaspiro[4.5]decan-9-amine
CID 97102884
N-[(2-methylcyclopentyl)methyl]-1-oxaspiro[5.5]undecan-4-amine
CID 107418106
N-(2-methylprop-2-enyl)-6-oxaspiro[4.5]decan-9-amine
CID 114616860

Frequently Asked Questions

What is the IUPAC name of 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol (CID 106129503) is 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol is OC1CCC(CNC2CCOC3(CCCC3)C2)C1.
What is the InChIKey of 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is CQISHERWWSBSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-14-4-3-12(9-14)11-16-13-5-8-18-15(10-13)6-1-2-7-15/h12-14,16-17H,1-11H2.
What are the key properties of 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol?
3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 253.39 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-oxaspiro[4.5]decan-9-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 106129503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).