Chemical ID: 4153184

Cc1ccccc1OCCCC(=O)NC2CCCC2
Chemical ID:
4153184
Name [?]:
N-cyclopentyl-4-(2-methylphenoxy)-butanamide
SMILES [?]:
Cc1ccccc1OCCCC(=O)NC2CCCC2
InChi [?]:
InChI=1/C16H23NO2/c1-13-7-2-5-10-15(13)19-12-6-11-16(18)17-14-8-3-4-9-14/h2,5,7,10,14H,3-4,6,8-9,11-12H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,4,17,18,5,10,3,16,19,6,11,9,2,15,7,12,14,13,8/E:(3,4)(8,9)/rA:19nCCCCCCCOCCCCONCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s11;d12;s12;s14;s15;s16;s17;s15s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H23NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.97336
Area:489.499
Solvation:-3.26412
Coulombic:-28.6561
Bond Count [?]
All:20
Single:16
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:261.359
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.11
LogP (Chemaxon):2.81

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Descriptor Annotations

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