[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol

C15H25NOS — CID 79070099

IUPAC[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol
SMILESCCN(CC)C1(C(O)c2csc(C)c2)CCCC1
InChIInChI=1S/C15H25NOS/c1-4-16(5-2)15(8-6-7-9-15)14(17)13-10-12(3)18-11-13/h10-11,14,17H,4-9H2,1-3H3
InChIKeyFSTFMCFUEKFEPC-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.74
Rot. Bonds5

About [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol

[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol (PubChem CID 79070099) has the molecular formula C15H25NOS and a molecular weight of 267.44 g/mol. Its IUPAC name is [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol.

Molecular Properties

Compound Name[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol
PubChem CID79070099
Molecular FormulaC15H25NOS
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol
SMILESCCN(CC)C1(C(O)c2csc(C)c2)CCCC1
InChIInChI=1S/C15H25NOS/c1-4-16(5-2)15(8-6-7-9-15)14(17)13-10-12(3)18-11-13/h10-11,14,17H,4-9H2,1-3H3
InChIKeyFSTFMCFUEKFEPC-UHFFFAOYSA-N
XLogP3.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol?
The IUPAC name of [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol (CID 79070099) is [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol.
What is the SMILES notation for [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol?
The canonical SMILES for [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol is CCN(CC)C1(C(O)c2csc(C)c2)CCCC1.
What is the InChIKey of [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol?
The InChIKey is FSTFMCFUEKFEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NOS/c1-4-16(5-2)15(8-6-7-9-15)14(17)13-10-12(3)18-11-13/h10-11,14,17H,4-9H2,1-3H3.
What are the key properties of [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol?
[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol has a molecular weight of 267.44 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol is sourced from PubChem (CID 79070099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).