2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol

C15H29NO2 — CID 55094532

IUPAC2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol
SMILESCCC1CCC(O)C(CN(CCOC)C2CC2)C1
InChIInChI=1S/C15H29NO2/c1-3-12-4-7-15(17)13(10-12)11-16(8-9-18-2)14-5-6-14/h12-15,17H,3-11H2,1-2H3
InChIKeyGVNGTGQPXITHMI-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.28
Rot. Bonds7

About 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol

2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol (PubChem CID 55094532) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol
PubChem CID55094532
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol
SMILESCCC1CCC(O)C(CN(CCOC)C2CC2)C1
InChIInChI=1S/C15H29NO2/c1-3-12-4-7-15(17)13(10-12)11-16(8-9-18-2)14-5-6-14/h12-15,17H,3-11H2,1-2H3
InChIKeyGVNGTGQPXITHMI-UHFFFAOYSA-N
XLogP2.28
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol?
The IUPAC name of 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol (CID 55094532) is 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol.
What is the SMILES notation for 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol?
The canonical SMILES for 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol is CCC1CCC(O)C(CN(CCOC)C2CC2)C1.
What is the InChIKey of 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol?
The InChIKey is GVNGTGQPXITHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-12-4-7-15(17)13(10-12)11-16(8-9-18-2)14-5-6-14/h12-15,17H,3-11H2,1-2H3.
What are the key properties of 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol?
2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 2.28, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-ethylcyclohexan-1-ol is sourced from PubChem (CID 55094532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).