Chemical ID: 4954027

c1cc(sc1)C(=O)CCN2CCCC2
Chemical ID:
4954027
Name [?]:
3-pyrrolidin-1-yl-1-(2-thienyl)propan-1-one
SMILES [?]:
c1cc(sc1)C(=O)CCN2CCCC2
InChi [?]:
InChI=1/C11H15NOS/c13-10(11-4-3-9-14-11)5-8-12-6-1-2-7-12/h3-4,9H,1-2,5-8H2
InChi Info:
AuxInfo=1/0/N:12,13,1,2,8,11,14,9,5,6,3,10,7,4/E:(1,2)(6,7)/rA:14nCCCSCCOCCNCCCC/rB:s1;d2;s3;d1s4;s3;d6;s6;s8;s9;s10;s11;s12;s10s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15NOS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.06565
Area:392.883
Solvation:-1.75643
Coulombic:-13.8417
Bond Count [?]
All:15
Single:12
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:209.309
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.08
LogP (Chemaxon):1.14

Name Annotations

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Descriptor Annotations

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