Chemical ID: 7102281

CCC(C)NCc1ccncc1
Chemical ID:
7102281
Name [?]:
N-(4-pyridylmethyl)butan-2-amine
SMILES [?]:
CCC(C)NCc1ccncc1
InChi [?]:
InChI=1/C10H16N2/c1-3-9(2)12-8-10-4-6-11-7-5-10/h4-7,9,12H,3,8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,4,2,8,12,9,11,6,3,7,10,5/E:(4,5)(6,7)/rA:12cCCCCNCCCCNCC/rB:s1;s2;s3;s3;s5;s6;s7;d8;s9;d10;d7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H16N2
All Atoms:28
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:7.27623
Area:356.757
Solvation:-1.64268
Coulombic:-13.8548
Bond Count [?]
All:12
Single:9
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:164.248
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.52
LogP (Chemaxon):1.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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