[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol

C15H29NO2 — CID 55055183

IUPAC[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol
SMILESCCN(CC1CCCO1)CC1(CO)CCCCC1
InChIInChI=1S/C15H29NO2/c1-2-16(11-14-7-6-10-18-14)12-15(13-17)8-4-3-5-9-15/h14,17H,2-13H2,1H3
InChIKeyABHQDKFKQQWEBA-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.43
Rot. Bonds6

About [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol

[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol (PubChem CID 55055183) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol
PubChem CID55055183
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol
SMILESCCN(CC1CCCO1)CC1(CO)CCCCC1
InChIInChI=1S/C15H29NO2/c1-2-16(11-14-7-6-10-18-14)12-15(13-17)8-4-3-5-9-15/h14,17H,2-13H2,1H3
InChIKeyABHQDKFKQQWEBA-UHFFFAOYSA-N
XLogP2.43
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.43
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]cyclohexyl]methanol?
The IUPAC name of [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol (CID 55055183) is [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol is CCN(CC1CCCO1)CC1(CO)CCCCC1.
What is the InChIKey of [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol?
The InChIKey is ABHQDKFKQQWEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-2-16(11-14-7-6-10-18-14)12-15(13-17)8-4-3-5-9-15/h14,17H,2-13H2,1H3.
What are the key properties of [1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol?
[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexyl]methanol has a molecular weight of 255.40 g/mol, XLogP of 2.43, 6 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]cyclohexyl]methanol is sourced from PubChem (CID 55055183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).