[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol

C15H27NO2 — CID 102787849

IUPAC[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol
SMILESCC1CCN(C2CCOC3(CCCC3)C2)C1CO
InChIInChI=1S/C15H27NO2/c1-12-4-8-16(14(12)11-17)13-5-9-18-15(10-13)6-2-3-7-15/h12-14,17H,2-11H2,1H3
InChIKeyMNCMZJKVKLEHNC-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.18
Rot. Bonds2

About [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol

[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol (PubChem CID 102787849) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol
PubChem CID102787849
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol
SMILESCC1CCN(C2CCOC3(CCCC3)C2)C1CO
InChIInChI=1S/C15H27NO2/c1-12-4-8-16(14(12)11-17)13-5-9-18-15(10-13)6-2-3-7-15/h12-14,17H,2-11H2,1H3
InChIKeyMNCMZJKVKLEHNC-UHFFFAOYSA-N
XLogP2.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol 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

[1-(1-oxaspiro[5.5]undecan-4-yl)pyrrolidin-2-yl]methanol
CID 79920119
[1-(6-oxaspiro[4.5]decan-9-yl)azepan-2-yl]methanol
CID 116637254
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylpyrrolidin-2-yl]methanamine
CID 102784497
(1-cyclopentyl-3-methylpyrrolidin-2-yl)methanol
CID 102788516
3-[1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]propan-1-ol
CID 79919663
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)pyrrolidin-2-yl]methanol
CID 79920343
3-[1-(1-oxaspiro[5.5]undecan-4-yl)pyrrolidin-2-yl]propan-1-ol
CID 79919417
1-[1-(1-oxaspiro[5.5]undecan-4-yl)pyrrolidin-2-yl]propan-2-ol
CID 114338570
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine
CID 115313242
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)piperidin-2-yl]methanol
CID 79920339
methyl 2-[1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-2-yl]acetate
CID 79919281
[4-ethyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperidin-2-yl]methanamine
CID 103353008

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol (CID 102787849) is [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol is CC1CCN(C2CCOC3(CCCC3)C2)C1CO.
What is the InChIKey of [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol?
The InChIKey is MNCMZJKVKLEHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-12-4-8-16(14(12)11-17)13-5-9-18-15(10-13)6-2-3-7-15/h12-14,17H,2-11H2,1H3.
What are the key properties of [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol?
[3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol has a molecular weight of 253.39 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 102787849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).