1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol

C17H34N2O2 — CID 81097682

IUPAC1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol
SMILESCCNC1C(CN2CCC(C)(O)CC2)C(C)(C)OC1(C)C
InChIInChI=1S/C17H34N2O2/c1-7-18-14-13(15(2,3)21-16(14,4)5)12-19-10-8-17(6,20)9-11-19/h13-14,18,20H,7-12H2,1-6H3
InChIKeyCOKDIBZSCGIQQC-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.01
Rot. Bonds4

About 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol

1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol (PubChem CID 81097682) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol
PubChem CID81097682
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol
SMILESCCNC1C(CN2CCC(C)(O)CC2)C(C)(C)OC1(C)C
InChIInChI=1S/C17H34N2O2/c1-7-18-14-13(15(2,3)21-16(14,4)5)12-19-10-8-17(6,20)9-11-19/h13-14,18,20H,7-12H2,1-6H3
InChIKeyCOKDIBZSCGIQQC-UHFFFAOYSA-N
XLogP2.01
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-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 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol?
The IUPAC name of 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol (CID 81097682) is 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol?
The canonical SMILES for 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol is CCNC1C(CN2CCC(C)(O)CC2)C(C)(C)OC1(C)C.
What is the InChIKey of 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol?
The InChIKey is COKDIBZSCGIQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-7-18-14-13(15(2,3)21-16(14,4)5)12-19-10-8-17(6,20)9-11-19/h13-14,18,20H,7-12H2,1-6H3.
What are the key properties of 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol?
1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol has a molecular weight of 298.47 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(ethylamino)-2,2,5,5-tetramethyloxolan-3-yl]methyl]-4-methylpiperidin-4-ol is sourced from PubChem (CID 81097682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).