3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol

C11H21NO2 — CID 115873758

IUPAC3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol
SMILESCC1(O)CCCN(CC2CCOC2)C1
InChIInChI=1S/C11H21NO2/c1-11(13)4-2-5-12(9-11)7-10-3-6-14-8-10/h10,13H,2-9H2,1H3
InChIKeyYUTVQEMBUFJOHS-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.87
Rot. Bonds2

About 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol

3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol (PubChem CID 115873758) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol
PubChem CID115873758
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol
SMILESCC1(O)CCCN(CC2CCOC2)C1
InChIInChI=1S/C11H21NO2/c1-11(13)4-2-5-12(9-11)7-10-3-6-14-8-10/h10,13H,2-9H2,1H3
InChIKeyYUTVQEMBUFJOHS-UHFFFAOYSA-N
XLogP0.87
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(oxolan-3-ylmethyl)pyrrolidine
CID 66580688
1-[(5R)-9-[[(3R)-oxolan-3-yl]methyl]-2,9-diazaspiro[4.5]decan-2-yl]ethanone
CID 98783278
1-[(6S)-8-[[(3S)-oxolan-3-yl]methyl]-1-oxa-4,8-diazaspiro[5.5]undecan-4-yl]ethanone
CID 124522552
2-(oxolan-3-ylmethyl)-2,8-diazaspiro[5.5]undecane
CID 102849336
(5S)-2-ethyl-9-[[(3S)-oxolan-3-yl]methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 124521977
N,4-dimethyl-1-(oxolan-3-ylmethyl)piperidin-4-amine
CID 115303950
3-ethyl-1-(oxan-3-ylmethyl)piperidine-3-carboxylic acid
CID 65068448
11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 134072746
3-methyl-1-(oxolan-3-ylmethyl)piperidine
CID 77147821
2-[4-(oxolan-3-ylmethyl)-1,4-diazepan-1-yl]ethanol
CID 63312870
3-methyl-1-(oxolan-3-ylmethyl)piperidin-4-ol
CID 114502613
1-(oxan-3-ylmethyl)pyrrolidine
CID 91805344

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol?
The IUPAC name of 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol (CID 115873758) is 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol?
The canonical SMILES for 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol is CC1(O)CCCN(CC2CCOC2)C1.
What is the InChIKey of 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol?
The InChIKey is YUTVQEMBUFJOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-11(13)4-2-5-12(9-11)7-10-3-6-14-8-10/h10,13H,2-9H2,1H3.
What are the key properties of 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol?
3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol has a molecular weight of 199.29 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 115873758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).