Chemical ID: 6686396

CCCCCC(C)(C)NC(C)(C)CC
Chemical ID:
6686396
Name [?]:
N-(1,1-dimethylpropyl)-2-methyl-heptan-2-amine
SMILES [?]:
CCCCCC(C)(C)NC(C)(C)CC
InChi [?]:
InChI=1/C13H29N/c1-7-9-10-11-13(5,6)14-12(3,4)8-2/h14H,7-11H2,1-6H3
InChi Info:
AuxInfo=1/0/N:1,14,11,12,7,8,2,13,3,4,5,10,6,9/E:(3,4)(5,6)/rA:14nCCCCCCCCNCCCCC/rB:s1;s2;s3;s4;s5;s6;s6;s6;s9;s10;s10;s10;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H29N
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:9.60687
Area:406.239
Solvation:-0.549112
Coulombic:-11.1509
Bond Count [?]
All:13
Single:13
Double:0
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:199.376
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.85
LogP (Chemaxon):3.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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