2-(cycloundecylmethylamino)ethanol

C14H29NO — CID 123930521

IUPAC2-(cycloundecylmethylamino)ethanol
SMILESOCCNCC1CCCCCCCCCC1
InChIInChI=1S/C14H29NO/c16-12-11-15-13-14-9-7-5-3-1-2-4-6-8-10-14/h14-16H,1-13H2
InChIKeyMHGPJWXPJIBXDW-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.10
Rot. Bonds4

About 2-(cycloundecylmethylamino)ethanol

2-(cycloundecylmethylamino)ethanol (PubChem CID 123930521) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-(cycloundecylmethylamino)ethanol.

Molecular Properties

Compound Name2-(cycloundecylmethylamino)ethanol
PubChem CID123930521
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-(cycloundecylmethylamino)ethanol
SMILESOCCNCC1CCCCCCCCCC1
InChIInChI=1S/C14H29NO/c16-12-11-15-13-14-9-7-5-3-1-2-4-6-8-10-14/h14-16H,1-13H2
InChIKeyMHGPJWXPJIBXDW-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.10
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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Related Compounds

3-(cyclooctylmethylamino)propan-1-ol
CID 115674336
2-(2-cycloheptylethylamino)ethanol
CID 22723010
2-cyclononyl-N-(cyclononylmethyl)ethanamine
CID 91347612
(cyclononylmethylamino)methanol
CID 137465268
2-[3-(cycloheptylmethylamino)propoxy]ethanol
CID 103992574
2-[3-(cyclooctylmethylamino)propoxy]ethanol
CID 113362814
N-(cyclobutylmethyl)-2-cyclohexylethanamine
CID 65457561
2-(2-cyclopentylethylamino)ethanol;hydrochloride
CID 22723115
N-(cycloheptylmethyl)-3-cyclopentylpropan-1-amine
CID 106008062
N'-(cyclohexylmethyl)-N-propylethane-1,2-diamine
CID 62559758
N-(cyclohexylmethyl)-N',N'-diethylpropane-1,3-diamine
CID 17215343
N'-(cyclohexylmethyl)-N-(cyclopropylmethyl)-N'-methylethane-1,2-diamine
CID 61447834

Frequently Asked Questions

What is the IUPAC name of 2-(cycloundecylmethylamino)ethanol?
The IUPAC name of 2-(cycloundecylmethylamino)ethanol (CID 123930521) is 2-(cycloundecylmethylamino)ethanol.
What is the SMILES notation for 2-(cycloundecylmethylamino)ethanol?
The canonical SMILES for 2-(cycloundecylmethylamino)ethanol is OCCNCC1CCCCCCCCCC1.
What is the InChIKey of 2-(cycloundecylmethylamino)ethanol?
The InChIKey is MHGPJWXPJIBXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c16-12-11-15-13-14-9-7-5-3-1-2-4-6-8-10-14/h14-16H,1-13H2.
What are the key properties of 2-(cycloundecylmethylamino)ethanol?
2-(cycloundecylmethylamino)ethanol has a molecular weight of 227.39 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cycloundecylmethylamino)ethanol is sourced from PubChem (CID 123930521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).