Chemical ID: 5191633

CNCC(COC1CCCCC1)O
Chemical ID:
5191633
Name [?]:
1-cyclohexoxy-3-methylamino-propan-2-ol
SMILES [?]:
CNCC(COC1CCCCC1)O
InChi [?]:
InChI=1/C10H21NO2/c1-11-7-9(12)8-13-10-5-3-2-4-6-10/h9-12H,2-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,10,9,11,8,12,3,5,4,7,2,13,6/E:(3,4)(5,6)/rA:13cCNCCCOCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s7s11;s4;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H21NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:5.3931
Area:385.53
Solvation:-4.24515
Coulombic:-33.003
Bond Count [?]
All:13
Single:13
Double:0
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:187.279
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:0.79
LogP (Chemaxon):0.84

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Experimental Annotations

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Descriptor Annotations

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