methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine

C11H25NO2 — CID 172576332

IUPACmethanol;3-(methoxymethyl)-1-propan-2-ylpiperidine
SMILESCO.COCC1CCCN(C(C)C)C1
InChIInChI=1S/C10H21NO.CH4O/c1-9(2)11-6-4-5-10(7-11)8-12-3;1-2/h9-10H,4-8H2,1-3H3;2H,1H3
InChIKeyFDTALHGVGNHOLD-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.36
Rot. Bonds3

About methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine

methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine (PubChem CID 172576332) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine.

Molecular Properties

Compound Namemethanol;3-(methoxymethyl)-1-propan-2-ylpiperidine
PubChem CID172576332
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Namemethanol;3-(methoxymethyl)-1-propan-2-ylpiperidine
SMILESCO.COCC1CCCN(C(C)C)C1
InChIInChI=1S/C10H21NO.CH4O/c1-9(2)11-6-4-5-10(7-11)8-12-3;1-2/h9-10H,4-8H2,1-3H3;2H,1H3
InChIKeyFDTALHGVGNHOLD-UHFFFAOYSA-N
XLogP1.36
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167395488
N,N-dimethyl-1-(1-propan-2-ylpiperidin-3-yl)methanamine;ethane;3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 163258201
(2S)-2-[(3R)-3-(methoxymethyl)piperidin-1-yl]propanoic acid
CID 129413747
[(3R)-1-propan-2-ylpiperidin-3-yl]methanol
CID 26722498
2-[[(3S)-1-propan-2-ylpiperidin-3-yl]methoxy]acetic acid
CID 162750163
2-[3-(methoxymethyl)piperidin-1-yl]pentan-3-one
CID 106587759
3-amino-2-[3-(methoxymethyl)piperidin-1-yl]hexan-1-ol
CID 106586650
(2R)-2-[(3R)-3-(methoxymethyl)piperidin-1-yl]butanoic acid
CID 129414278
N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine
CID 106589290
methanol;3-methoxy-1-propan-2-ylpiperidine
CID 172576314
(3S)-3-(2,2-dimethylpropyl)-1-propan-2-ylpiperidine
CID 164786402
(3S)-3-(methoxymethyl)-1-methylpiperidine
CID 58134332

Frequently Asked Questions

What is the IUPAC name of methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine?
The IUPAC name of methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine (CID 172576332) is methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine.
What is the SMILES notation for methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine?
The canonical SMILES for methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine is CO.COCC1CCCN(C(C)C)C1.
What is the InChIKey of methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine?
The InChIKey is FDTALHGVGNHOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.CH4O/c1-9(2)11-6-4-5-10(7-11)8-12-3;1-2/h9-10H,4-8H2,1-3H3;2H,1H3.
What are the key properties of methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine?
methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine has a molecular weight of 203.33 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine is sourced from PubChem (CID 172576332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).