2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol

C11H21NO — CID 115631817

IUPAC2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol
SMILESC=CCN(CCO)CC1CCCC1
InChIInChI=1S/C11H21NO/c1-2-7-12(8-9-13)10-11-5-3-4-6-11/h2,11,13H,1,3-10H2
InChIKeyYAZOQZPPMLDKNT-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds6

About 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol

2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol (PubChem CID 115631817) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol
PubChem CID115631817
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol
SMILESC=CCN(CCO)CC1CCCC1
InChIInChI=1S/C11H21NO/c1-2-7-12(8-9-13)10-11-5-3-4-6-11/h2,11,13H,1,3-10H2
InChIKeyYAZOQZPPMLDKNT-UHFFFAOYSA-N
XLogP1.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol?
The IUPAC name of 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol (CID 115631817) is 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol.
What is the SMILES notation for 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol?
The canonical SMILES for 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol is C=CCN(CCO)CC1CCCC1.
What is the InChIKey of 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol?
The InChIKey is YAZOQZPPMLDKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-7-12(8-9-13)10-11-5-3-4-6-11/h2,11,13H,1,3-10H2.
What are the key properties of 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol?
2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol has a molecular weight of 183.29 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentylmethyl(prop-2-enyl)amino]ethanol is sourced from PubChem (CID 115631817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).