Chemical ID: 5603525

CCCCCCC(=O)NN=C1c2ccccc2NC1=O
Chemical ID:
5603525
Name [?]:
N-(2-oxoindolin-3-ylidene)aminoheptanamide
SMILES [?]:
CCCCCCC(=O)NN=C1c2ccccc2NC1=O
InChi [?]:
InChI=1/C15H19N3O2/c1-2-3-4-5-10-13(19)17-18-14-11-8-6-7-9-12(11)16-15(14)20/h6-9H,2-5,10H2,1H3,(H,17,19)(H,16,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,14,15,13,16,6,12,17,7,11,19,18,9,10,8,20/rA:20nCCCCCCCONNCCCCCCCNCO/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;w10;s11;s12;d13;s14;d15;d12s16;s17;s11s18;d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H19N3O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.60351
Area:504.355
Solvation:-4.00537
Coulombic:-40.7188
Bond Count [?]
All:21
Single:15
Double:6
Rotors:7
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:273.33
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:3.67
LogP (Chemaxon):3.12

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Descriptor Annotations

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