[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone

C12H17NOS — CID 79067610

IUPAC[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone
SMILESCN(C)C1(C(=O)c2cccs2)CCCC1
InChIInChI=1S/C12H17NOS/c1-13(2)12(7-3-4-8-12)11(14)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyUKYUPIWFEZCGKM-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.81
Rot. Bonds3

About [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone

[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone (PubChem CID 79067610) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone.

Molecular Properties

Compound Name[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone
PubChem CID79067610
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC Name[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone
SMILESCN(C)C1(C(=O)c2cccs2)CCCC1
InChIInChI=1S/C12H17NOS/c1-13(2)12(7-3-4-8-12)11(14)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyUKYUPIWFEZCGKM-UHFFFAOYSA-N
XLogP2.81
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(dimethylamino)cyclopentyl]-(3-methylthiophen-2-yl)methanone
CID 79991094
(1-methoxycycloheptyl)-thiophen-2-ylmethanone
CID 116750550
(1-methoxycyclobutyl)-thiophen-2-ylmethanone
CID 116707010
(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone
CID 116614225
1-[1-(dimethylamino)cycloheptyl]-3-thiophen-2-ylpropan-1-one
CID 79074938
1-(thiophene-2-carbonyl)cyclopropane-1-carboxylic acid
CID 116920934
[1-(dimethylamino)cyclohexyl]-[2-(trifluoromethyl)phenyl]methanone
CID 79062257
1-[methyl-[3-(thiophene-2-carbonylamino)propanoyl]amino]cyclohexane-1-carboxylic acid
CID 120539260
[1-(dimethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanone
CID 79067454
[1-(dimethylamino)cyclopentyl]-(furan-2-yl)methanone
CID 79067370
(3-propylpyrrolidin-3-yl)-thiophen-2-ylmethanone
CID 67327801
[1-(dimethylamino)cycloheptyl]-(5-methylthiophen-3-yl)methanone
CID 79074712

Frequently Asked Questions

What is the IUPAC name of [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone?
The IUPAC name of [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone (CID 79067610) is [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone.
What is the SMILES notation for [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone?
The canonical SMILES for [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone is CN(C)C1(C(=O)c2cccs2)CCCC1.
What is the InChIKey of [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone?
The InChIKey is UKYUPIWFEZCGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c1-13(2)12(7-3-4-8-12)11(14)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3.
What are the key properties of [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone?
[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone has a molecular weight of 223.34 g/mol, XLogP of 2.81, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone is sourced from PubChem (CID 79067610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).