1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol

C14H27NO2 — CID 65208916

IUPAC1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCCN(CC1CCCO1)CC1(O)CCCCC1
InChIInChI=1S/C14H27NO2/c1-2-15(11-13-7-6-10-17-13)12-14(16)8-4-3-5-9-14/h13,16H,2-12H2,1H3
InChIKeyAYLYIFSJJUSHCH-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.18
Rot. Bonds5

About 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol

1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol (PubChem CID 65208916) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
PubChem CID65208916
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCCN(CC1CCCO1)CC1(O)CCCCC1
InChIInChI=1S/C14H27NO2/c1-2-15(11-13-7-6-10-17-13)12-14(16)8-4-3-5-9-14/h13,16H,2-12H2,1H3
InChIKeyAYLYIFSJJUSHCH-UHFFFAOYSA-N
XLogP2.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol (CID 65208916) is 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol is CCN(CC1CCCO1)CC1(O)CCCCC1.
What is the InChIKey of 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is AYLYIFSJJUSHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-15(11-13-7-6-10-17-13)12-14(16)8-4-3-5-9-14/h13,16H,2-12H2,1H3.
What are the key properties of 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 241.37 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 65208916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).