Chemical ID: 6213269

CC(C)(C)C(=O)NCC12CC3CC(C1)CC(C3)C2
Chemical ID:
6213269
Name [?]:
N-(1-adamantylmethyl)-2,2-dimethyl-propanamide
SMILES [?]:
CC(C)(C)C(=O)NCC12CC3CC(C1)CC(C3)C2
InChi [?]:
InChI=1/C16H27NO/c1-15(2,3)14(18)17-10-16-7-11-4-12(8-16)6-13(5-11)9-16/h11-13H,4-10H2,1-3H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,3,4,12,15,17,14,10,18,8,13,11,16,5,2,9,7,6/E:(1,2,3)(4,5,6)(7,8,9)(11,12,13)/rA:18nCCCCCONCCCCCCCCCCC/rB:s1;s2;s2;s2;d5;s5;s7;s8;s9;s10;s11;s12;s9s13;s13;s15;s11s16;s9s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H27NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.27268
Area:424.485
Solvation:-1.33945
Coulombic:-22.7671
Bond Count [?]
All:20
Single:19
Double:1
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:249.392
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.14
LogP (Chemaxon):3.46

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Descriptor Annotations

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