4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol

C14H30N2O2 — CID 64827462

IUPAC4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
SMILESCCOC1CCN(C(C)CC(C)(CO)NC)CC1
InChIInChI=1S/C14H30N2O2/c1-5-18-13-6-8-16(9-7-13)12(2)10-14(3,11-17)15-4/h12-13,15,17H,5-11H2,1-4H3
InChIKeyYESRTXNGITWTEG-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.24
Rot. Bonds7

About 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol

4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol (PubChem CID 64827462) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol.

Molecular Properties

Compound Name4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
PubChem CID64827462
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
SMILESCCOC1CCN(C(C)CC(C)(CO)NC)CC1
InChIInChI=1S/C14H30N2O2/c1-5-18-13-6-8-16(9-7-13)12(2)10-14(3,11-17)15-4/h12-13,15,17H,5-11H2,1-4H3
InChIKeyYESRTXNGITWTEG-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol?
The IUPAC name of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol (CID 64827462) is 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol.
What is the SMILES notation for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol?
The canonical SMILES for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol is CCOC1CCN(C(C)CC(C)(CO)NC)CC1.
What is the InChIKey of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol?
The InChIKey is YESRTXNGITWTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-18-13-6-8-16(9-7-13)12(2)10-14(3,11-17)15-4/h12-13,15,17H,5-11H2,1-4H3.
What are the key properties of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol?
4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol has a molecular weight of 258.41 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol is sourced from PubChem (CID 64827462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).