2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol

C14H29NO2 — CID 106589129

IUPAC2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol
SMILESCCCC(C)(CO)CN1CCCC(COC)C1
InChIInChI=1S/C14H29NO2/c1-4-7-14(2,12-16)11-15-8-5-6-13(9-15)10-17-3/h13,16H,4-12H2,1-3H3
InChIKeyNWFGCBDNUCHWIJ-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.14
Rot. Bonds7

About 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol

2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol (PubChem CID 106589129) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol
PubChem CID106589129
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol
SMILESCCCC(C)(CO)CN1CCCC(COC)C1
InChIInChI=1S/C14H29NO2/c1-4-7-14(2,12-16)11-15-8-5-6-13(9-15)10-17-3/h13,16H,4-12H2,1-3H3
InChIKeyNWFGCBDNUCHWIJ-UHFFFAOYSA-N
XLogP2.14
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentanoic acid
CID 106589084
N-tert-butyl-2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylbutan-1-amine
CID 106588959
3-[3-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpropan-1-amine
CID 106587324
2-[(3-methoxypiperidin-1-yl)methyl]-2-methylbutan-1-ol
CID 102967560
2-amino-3-[3-(methoxymethyl)piperidin-1-yl]-2-methylpropanenitrile
CID 106588532
1,1,1-trifluoro-3-[3-(methoxymethyl)piperidin-1-yl]propan-2-ol
CID 104567152
methyl 2-amino-3-[3-(methoxymethyl)piperidin-1-yl]-2-methylpropanoate
CID 106588642
1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol
CID 62272555
2-ethyl-5-[3-(methoxymethyl)piperidin-1-yl]-2-(methylamino)pentan-1-ol
CID 106809961
2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol
CID 64810845
2-ethyl-2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-N-propylbutan-1-amine
CID 106588987
2-[(4-cyclopropylpiperazin-1-yl)methyl]-2-methylpentan-1-ol
CID 62266189

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol?
The IUPAC name of 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol (CID 106589129) is 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol.
What is the SMILES notation for 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol?
The canonical SMILES for 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol is CCCC(C)(CO)CN1CCCC(COC)C1.
What is the InChIKey of 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol?
The InChIKey is NWFGCBDNUCHWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-4-7-14(2,12-16)11-15-8-5-6-13(9-15)10-17-3/h13,16H,4-12H2,1-3H3.
What are the key properties of 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol?
2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol has a molecular weight of 243.39 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol is sourced from PubChem (CID 106589129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).