6-[2-(ethylamino)ethyl]undecan-6-ol

C15H33NO — CID 23063797

IUPAC6-[2-(ethylamino)ethyl]undecan-6-ol
SMILESCCCCCC(O)(CCCCC)CCNCC
InChIInChI=1S/C15H33NO/c1-4-7-9-11-15(17,12-10-8-5-2)13-14-16-6-3/h16-17H,4-14H2,1-3H3
InChIKeyUCFMTJPCODBHSZ-UHFFFAOYSA-N
MW243.43 g/mol
LogP3.88
Rot. Bonds12

About 6-[2-(ethylamino)ethyl]undecan-6-ol

6-[2-(ethylamino)ethyl]undecan-6-ol (PubChem CID 23063797) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 6-[2-(ethylamino)ethyl]undecan-6-ol.

Molecular Properties

Compound Name6-[2-(ethylamino)ethyl]undecan-6-ol
PubChem CID23063797
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name6-[2-(ethylamino)ethyl]undecan-6-ol
SMILESCCCCCC(O)(CCCCC)CCNCC
InChIInChI=1S/C15H33NO/c1-4-7-9-11-15(17,12-10-8-5-2)13-14-16-6-3/h16-17H,4-14H2,1-3H3
InChIKeyUCFMTJPCODBHSZ-UHFFFAOYSA-N
XLogP3.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(ethylamino)ethyl]undecan-6-ol?
The IUPAC name of 6-[2-(ethylamino)ethyl]undecan-6-ol (CID 23063797) is 6-[2-(ethylamino)ethyl]undecan-6-ol.
What is the SMILES notation for 6-[2-(ethylamino)ethyl]undecan-6-ol?
The canonical SMILES for 6-[2-(ethylamino)ethyl]undecan-6-ol is CCCCCC(O)(CCCCC)CCNCC.
What is the InChIKey of 6-[2-(ethylamino)ethyl]undecan-6-ol?
The InChIKey is UCFMTJPCODBHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-4-7-9-11-15(17,12-10-8-5-2)13-14-16-6-3/h16-17H,4-14H2,1-3H3.
What are the key properties of 6-[2-(ethylamino)ethyl]undecan-6-ol?
6-[2-(ethylamino)ethyl]undecan-6-ol has a molecular weight of 243.43 g/mol, XLogP of 3.88, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(ethylamino)ethyl]undecan-6-ol is sourced from PubChem (CID 23063797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).