[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol

C14H25N3O2 — CID 72843654

IUPAC[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol
SMILESCOCCC1(CO)CCCN(Cc2nc[nH]c2C)C1
InChIInChI=1S/C14H25N3O2/c1-12-13(16-11-15-12)8-17-6-3-4-14(9-17,10-18)5-7-19-2/h11,18H,3-10H2,1-2H3,(H,15,16)
InChIKeyTUALKOSEZRURSO-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.33
Rot. Bonds6

About [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol

[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol (PubChem CID 72843654) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol
PubChem CID72843654
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol
SMILESCOCCC1(CO)CCCN(Cc2nc[nH]c2C)C1
InChIInChI=1S/C14H25N3O2/c1-12-13(16-11-15-12)8-17-6-3-4-14(9-17,10-18)5-7-19-2/h11,18H,3-10H2,1-2H3,(H,15,16)
InChIKeyTUALKOSEZRURSO-UHFFFAOYSA-N
XLogP1.33
TPSA61.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol?
The IUPAC name of [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol (CID 72843654) is [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol.
What is the SMILES notation for [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol?
The canonical SMILES for [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol is COCCC1(CO)CCCN(Cc2nc[nH]c2C)C1.
What is the InChIKey of [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol?
The InChIKey is TUALKOSEZRURSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-12-13(16-11-15-12)8-17-6-3-4-14(9-17,10-18)5-7-19-2/h11,18H,3-10H2,1-2H3,(H,15,16).
What are the key properties of [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol?
[3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol has a molecular weight of 267.37 g/mol, XLogP of 1.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyethyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methanol is sourced from PubChem (CID 72843654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).