2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol

C10H18ClNO — CID 62014468

IUPAC2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol
SMILESC=C(Cl)CN(CCO)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-9(11)8-12(6-7-13)10-4-2-3-5-10/h10,13H,1-8H2
InChIKeyKEDDEXSKRAOJIQ-UHFFFAOYSA-N
MW203.71 g/mol
LogP1.98
Rot. Bonds5

About 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol

2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol (PubChem CID 62014468) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol
PubChem CID62014468
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol
SMILESC=C(Cl)CN(CCO)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-9(11)8-12(6-7-13)10-4-2-3-5-10/h10,13H,1-8H2
InChIKeyKEDDEXSKRAOJIQ-UHFFFAOYSA-N
XLogP1.98
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol?
The IUPAC name of 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol (CID 62014468) is 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol.
What is the SMILES notation for 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol?
The canonical SMILES for 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol is C=C(Cl)CN(CCO)C1CCCC1.
What is the InChIKey of 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol?
The InChIKey is KEDDEXSKRAOJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-9(11)8-12(6-7-13)10-4-2-3-5-10/h10,13H,1-8H2.
What are the key properties of 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol?
2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol has a molecular weight of 203.71 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol is sourced from PubChem (CID 62014468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).