2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol

C15H27NO2 — CID 58779502

IUPAC2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol
SMILESOCCN(CCO)CC1CC2CC1C1CCCC21
InChIInChI=1S/C15H27NO2/c17-6-4-16(5-7-18)10-12-8-11-9-15(12)14-3-1-2-13(11)14/h11-15,17-18H,1-10H2
InChIKeyYBRCPENOTIAZFM-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.35
Rot. Bonds6

About 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol

2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol (PubChem CID 58779502) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol
PubChem CID58779502
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol
SMILESOCCN(CCO)CC1CC2CC1C1CCCC21
InChIInChI=1S/C15H27NO2/c17-6-4-16(5-7-18)10-12-8-11-9-15(12)14-3-1-2-13(11)14/h11-15,17-18H,1-10H2
InChIKeyYBRCPENOTIAZFM-UHFFFAOYSA-N
XLogP1.35
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol?
The IUPAC name of 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol (CID 58779502) is 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol.
What is the SMILES notation for 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol?
The canonical SMILES for 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol is OCCN(CCO)CC1CC2CC1C1CCCC21.
What is the InChIKey of 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol?
The InChIKey is YBRCPENOTIAZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-6-4-16(5-7-18)10-12-8-11-9-15(12)14-3-1-2-13(11)14/h11-15,17-18H,1-10H2.
What are the key properties of 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol?
2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol has a molecular weight of 253.39 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(8-tricyclo[5.2.1.02,6]decanylmethyl)amino]ethanol is sourced from PubChem (CID 58779502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).