2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol

C13H23NO — CID 61056171

IUPAC2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol
SMILESOCC(NC1CCCC1)C1CC=CCC1
InChIInChI=1S/C13H23NO/c15-10-13(11-6-2-1-3-7-11)14-12-8-4-5-9-12/h1-2,11-15H,3-10H2
InChIKeyNHUBKKZXXMOEPY-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.24
Rot. Bonds4

About 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol

2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol (PubChem CID 61056171) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol.

Molecular Properties

Compound Name2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol
PubChem CID61056171
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol
SMILESOCC(NC1CCCC1)C1CC=CCC1
InChIInChI=1S/C13H23NO/c15-10-13(11-6-2-1-3-7-11)14-12-8-4-5-9-12/h1-2,11-15H,3-10H2
InChIKeyNHUBKKZXXMOEPY-UHFFFAOYSA-N
XLogP2.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Amino-2-(cyclohex-3-en-1-yl)ethan-1-ol
CID 61056225
2-(Cyclohex-3-en-1-ylmethylamino)-2-methylpentan-1-ol
CID 75387507
(2S)-3-(4-fluorocyclohexa-2,4-dien-1-yl)-2-(methylamino)propan-1-ol
CID 70320951
[(1R,2E)-2-[[(2S)-pyrrolidin-2-yl]methylidene]cyclopentyl]methanol
CID 12136969
1-Cyclohex-3-en-1-yl-2-(cyclohexylamino)ethanol
CID 134924288
2-(Tert-butylamino)-1-cyclohex-3-en-1-ylethanol
CID 134986213
2-Cyclohex-3-en-1-yl-2-(2,2,2-trifluoroethylamino)ethanol
CID 61044928
1-(2-Bicyclo[2.2.1]hept-5-enylamino)hexan-2-ol
CID 20649851
2-(2-Bicyclo[2.2.1]hept-5-enylamino)hexan-1-ol
CID 20649891
2-(2-Bicyclo[2.2.1]hept-5-enylmethylamino)hexan-1-ol
CID 20649894
2-Azabicyclo[2.2.1]hept-5-en-3-ylmethanol
CID 45092477
2-[(5,6-Diethylcyclohex-3-en-1-yl)amino]ethanol
CID 53678619

Frequently Asked Questions

What is the IUPAC name of 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol?
The IUPAC name of 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol (CID 61056171) is 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol.
What is the SMILES notation for 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol?
The canonical SMILES for 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol is OCC(NC1CCCC1)C1CC=CCC1.
What is the InChIKey of 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol?
The InChIKey is NHUBKKZXXMOEPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c15-10-13(11-6-2-1-3-7-11)14-12-8-4-5-9-12/h1-2,11-15H,3-10H2.
What are the key properties of 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol?
2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol has a molecular weight of 209.33 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohex-3-en-1-yl-2-(cyclopentylamino)ethanol is sourced from PubChem (CID 61056171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).