1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one

C12H17NOS — CID 116558991

IUPAC1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one
SMILESO=C(CNC1CCCC1)Cc1cccs1
InChIInChI=1S/C12H17NOS/c14-11(8-12-6-3-7-15-12)9-13-10-4-1-2-5-10/h3,6-7,10,13H,1-2,4-5,8-9H2
InChIKeyUYMAMHBQSOTLLS-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.39
Rot. Bonds5

About 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one

1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one (PubChem CID 116558991) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one.

Molecular Properties

Compound Name1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one
PubChem CID116558991
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC Name1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one
SMILESO=C(CNC1CCCC1)Cc1cccs1
InChIInChI=1S/C12H17NOS/c14-11(8-12-6-3-7-15-12)9-13-10-4-1-2-5-10/h3,6-7,10,13H,1-2,4-5,8-9H2
InChIKeyUYMAMHBQSOTLLS-UHFFFAOYSA-N
XLogP2.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-(cyclopentylamino)-3-(furan-2-yl)propan-2-one
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1-cyclohexyl-2-thiophen-2-ylethanone
CID 61056881
1-(cyclopentylamino)-3-(2,6-dichlorophenyl)propan-2-one
CID 116558986
2-(cyclopropylamino)-N-(2-thiophen-2-ylethyl)acetamide
CID 60671964
2-(cyclopentylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 60847966
1-cyclohexyl-3-[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]urea
CID 110820715
2-[[2-(cyclopentylamino)acetyl]amino]-2-thiophen-2-ylacetic acid
CID 115284804
1-thiophen-2-ylpentane-2,4-dione
CID 154402079
1-(cyclopropylamino)-3-(1,3-thiazol-5-yl)propan-2-one
CID 116555141

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one?
The IUPAC name of 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one (CID 116558991) is 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one.
What is the SMILES notation for 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one?
The canonical SMILES for 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one is O=C(CNC1CCCC1)Cc1cccs1.
What is the InChIKey of 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one?
The InChIKey is UYMAMHBQSOTLLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c14-11(8-12-6-3-7-15-12)9-13-10-4-1-2-5-10/h3,6-7,10,13H,1-2,4-5,8-9H2.
What are the key properties of 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one?
1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one has a molecular weight of 223.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)-3-thiophen-2-ylpropan-2-one is sourced from PubChem (CID 116558991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).