Chemical ID: 4577737

CN1CCc2c3ccccc3[nH]c2C1
Chemical ID:
4577737
Name [?]:
None
SMILES [?]:
CN1CCc2c3ccccc3[nH]c2C1
InChi [?]:
InChI=1/C12H14N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-5,13H,6-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,9,7,10,4,3,14,6,5,11,13,12,2/rA:14cCNCCCCCCCCCNCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;d5s12;s2s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H14N2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.11146
Area:343.877
Solvation:-1.48547
Coulombic:-16.5685
Bond Count [?]
All:16
Single:12
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:186.253
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.7
LogP (Chemaxon):2.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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