2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol

C12H19Cl2NO — CID 104893916

IUPAC2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CC(Cl)=CCl
InChIInChI=1S/C12H19Cl2NO/c13-7-9(14)8-15-6-2-4-11(15)10-3-1-5-12(10)16/h7,10-12,16H,1-6,8H2
InChIKeyHEEJMYBNJVGCJX-UHFFFAOYSA-N
MW264.20 g/mol
LogP2.93
Rot. Bonds3

About 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol

2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol (PubChem CID 104893916) has the molecular formula C12H19Cl2NO and a molecular weight of 264.20 g/mol. Its IUPAC name is 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
PubChem CID104893916
Molecular FormulaC12H19Cl2NO
Molecular Weight264.20 g/mol
Exact Mass263.08
IUPAC Name2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CC(Cl)=CCl
InChIInChI=1S/C12H19Cl2NO/c13-7-9(14)8-15-6-2-4-11(15)10-3-1-5-12(10)16/h7,10-12,16H,1-6,8H2
InChIKeyHEEJMYBNJVGCJX-UHFFFAOYSA-N
XLogP2.93
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.20
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2,3-Dichloroprop-2-enyl)piperidin-2-yl]cyclopentan-1-ol
CID 104893918
2-[1-(3-Chloro-2-methylprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 106440951
2-[1-(2,3-Dichloroprop-2-enyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 113569284
2-[1-(3-Chloro-2-methylprop-2-enyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114188990
2-[1-(2-Methylprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339132
2-(1-Prop-2-enylpyrrolidin-2-yl)cyclopentan-1-ol
CID 114339174
2-[1-[(E)-3-chloroprop-2-enyl]pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339242
2-[1-(2-Chloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339388
2-[1-[(E)-3-chloroprop-2-enyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339589
2-[1-(2-Chloroprop-2-enyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339723
2-[1-(2-Chloroprop-2-enyl)piperidin-2-yl]cyclopentan-1-ol
CID 114340302

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol (CID 104893916) is 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol is OC1CCCC1C1CCCN1CC(Cl)=CCl.
What is the InChIKey of 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The InChIKey is HEEJMYBNJVGCJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19Cl2NO/c13-7-9(14)8-15-6-2-4-11(15)10-3-1-5-12(10)16/h7,10-12,16H,1-6,8H2.
What are the key properties of 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol?
2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol has a molecular weight of 264.20 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,3-dichloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 104893916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).