Chemical ID: 4177343

Cc1cccc(c1)C2c3c(c4ccccc4[nH]3)CCN2
Chemical ID:
4177343
Name [?]:
None
SMILES [?]:
Cc1cccc(c1)C2c3c(c4ccccc4[nH]3)CCN2
InChi [?]:
InChI=1/C18H18N2/c1-12-5-4-6-13(11-12)17-18-15(9-10-19-17)14-7-2-3-8-16(14)20-18/h2-8,11,17,19-20H,9-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,14,4,3,5,12,15,18,19,7,2,6,11,10,16,8,9,20,17/rA:20cCCCCCCCCCCCCCCCCNCCN/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;s11;d12;s13;d14;d11s15;s9s16;s10;s18;s8s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:9.52215
Area:446.369
Solvation:-1.63707
Coulombic:-22.302
Bond Count [?]
All:23
Single:16
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:262.349
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.47
LogP (Chemaxon):4.03

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Descriptor Annotations

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