Chemical ID: 4116837

C1CCN(C1)CCC#N
Chemical ID:
4116837
Name [?]:
3-pyrrolidin-1-ylpropanenitrile
SMILES [?]:
C1CCN(C1)CCC#N
InChi [?]:
InChI=1/C7H12N2/c8-4-3-7-9-5-1-2-6-9/h1-3,5-7H2
InChi Info:
AuxInfo=1/0/N:1,2,7,8,5,3,6,9,4/E:(1,2)(5,6)/rA:9nCCCNCCCCN/rB:s1;s2;s3;s1s4;s4;s6;s7;t8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H12N2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:6.01197
Area:297.155
Solvation:-1.41691
Coulombic:-7.04824
Bond Count [?]
All:9
Single:8
Double:0
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:124.184
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.22
LogP (Chemaxon):0.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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