Chemical ID: 5457049

CC(C(=O)NCC1CCCO1)Cl
Chemical ID:
5457049
Name [?]:
2-chloro-N-(tetrahydrofuran-2-ylmethyl)propanamide
SMILES [?]:
CC(C(=O)NCC1CCCO1)Cl
InChi [?]:
InChI=1/C8H14ClNO2/c1-6(9)8(11)10-5-7-3-2-4-12-7/h6-7H,2-5H2,1H3,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,9,8,10,6,2,7,3,12,5,4,11/rA:12cCCCONCCCCCOCl/rB:s1;s2;d3;s3;s5;s6;s7;s8;s9;s7s10;s2;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14ClNO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:2
ZAP Information [?]
Total:6.15664
Area:370.69
Solvation:-3.11061
Coulombic:-28.9258
Bond Count [?]
All:12
Single:11
Double:1
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:191.655
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.59
LogP (Chemaxon):0.57

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Descriptor Annotations

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