1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol

C15H23NO — CID 79067226

IUPAC1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol
SMILESCN(C)C1(C(O)Cc2ccccc2)CCCC1
InChIInChI=1S/C15H23NO/c1-16(2)15(10-6-7-11-15)14(17)12-13-8-4-3-5-9-13/h3-5,8-9,14,17H,6-7,10-12H2,1-2H3
InChIKeySMYANXLRABLVMQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.46
Rot. Bonds4

About 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol

1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol (PubChem CID 79067226) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol.

Molecular Properties

Compound Name1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol
PubChem CID79067226
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol
SMILESCN(C)C1(C(O)Cc2ccccc2)CCCC1
InChIInChI=1S/C15H23NO/c1-16(2)15(10-6-7-11-15)14(17)12-13-8-4-3-5-9-13/h3-5,8-9,14,17H,6-7,10-12H2,1-2H3
InChIKeySMYANXLRABLVMQ-UHFFFAOYSA-N
XLogP2.46
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol?
The IUPAC name of 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol (CID 79067226) is 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol.
What is the SMILES notation for 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol?
The canonical SMILES for 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol is CN(C)C1(C(O)Cc2ccccc2)CCCC1.
What is the InChIKey of 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol?
The InChIKey is SMYANXLRABLVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-16(2)15(10-6-7-11-15)14(17)12-13-8-4-3-5-9-13/h3-5,8-9,14,17H,6-7,10-12H2,1-2H3.
What are the key properties of 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol?
1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol has a molecular weight of 233.36 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol is sourced from PubChem (CID 79067226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).