Chemical ID: 4582587

CC=C1CN2CCC34C2CC1C(C3Nc5c4cccc5)C
Chemical ID:
4582587
Name [?]:
None
SMILES [?]:
CC=C1CN2CCC34C2CC1C(C3Nc5c4cccc5)C
InChi [?]:
InChI=1/C19H24N2/c1-3-13-11-21-9-8-19-15-6-4-5-7-16(15)20-18(19)12(2)14(13)10-17(19)21/h3-7,12,14,17-18,20H,8-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,21,2,18,19,17,20,7,6,10,4,12,3,11,16,15,9,13,8,14,5/rA:21cCCCCNCCCCCCCCNCCCCCCC/rB:s1;w2;s3;s4;s5;s6;s7;s5s8;s9;s3s10;s11;s8s12;s13;s14;s8s15;d16;s17;d18;d15s19;s12;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24N2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:6
ZAP Information [?]
Total:9.38365
Area:424.441
Solvation:-1.22738
Coulombic:-19.2904
Bond Count [?]
All:25
Single:21
Double:4
Rotors:0
Chiral:1
Rigid Segments:1
Chemical Properties
Molecular Weight:280.407
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.52
LogP (Chemaxon):2.99

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Experimental Annotations

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Descriptor Annotations

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