Chemical ID: 5849790

CCC(C)(C)C(=O)NCc1ccccc1OC
Chemical ID:
5849790
Name [?]:
N-[(2-methoxyphenyl)methyl]-2,2-dimethyl-butanamide
SMILES [?]:
CCC(C)(C)C(=O)NCc1ccccc1OC
InChi [?]:
InChI=1/C14H21NO2/c1-5-14(2,3)13(16)15-10-11-8-6-7-9-12(11)17-4/h6-9H,5,10H2,1-4H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,4,5,17,2,12,13,11,14,9,10,15,6,3,8,7,16/E:(2,3)/rA:17nCCCCCCONCCCCCCCOC/rB:s1;s2;s3;s3;s3;d6;s6;s8;s9;s10;d11;s12;d13;d10s14;s15;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.96677
Area:438.291
Solvation:-2.9905
Coulombic:-29.9309
Bond Count [?]
All:17
Single:13
Double:4
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:235.322
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.65
LogP (Chemaxon):2.99

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Descriptor Annotations

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