Chemical ID: 6480695

c1ccc2c(c1)CCN2CCC(=O)N3CCCC3
Chemical ID:
6480695
Name [?]:
3-indolin-1-yl-1-pyrrolidin-1-yl-propan-1-one
SMILES [?]:
c1ccc2c(c1)CCN2CCC(=O)N3CCCC3
InChi [?]:
InChI=1/C15H20N2O/c18-15(17-9-3-4-10-17)8-12-16-11-7-13-5-1-2-6-14(13)16/h1-2,5-6H,3-4,7-12H2
InChi Info:
AuxInfo=1/0/N:1,2,16,17,6,3,7,11,15,18,8,10,5,4,12,9,14,13/E:(3,4)(9,10)/rA:18cCCCCCCCCNCCCONCCCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s4s8;s9;s10;s11;d12;s12;s14;s15;s16;s14s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H20N2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:8.59594
Area:441.671
Solvation:-2.44583
Coulombic:-22.3387
Bond Count [?]
All:20
Single:16
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:244.332
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.06
LogP (Chemaxon):1.97

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