Chemical ID: 6343302

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)(C)C
Chemical ID:
6343302
Name [?]:
N-[1-(1-adamantyl)ethyl]-2,2-dimethyl-propanamide
SMILES [?]:
CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)(C)C
InChi [?]:
InChI=1/C17H29NO/c1-11(18-15(19)16(2,3)4)17-8-12-5-13(9-17)7-14(6-12)10-17/h11-14H,5-10H2,1-4H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,17,18,19,6,9,11,8,4,12,2,7,5,10,14,16,3,13,15/E:(2,3,4)(5,6,7)(8,9,10)(12,13,14)/rA:19cCCCCCCCCCCCCNCOCCCC/rB:s1;s2;s3;s4;s5;s6;s3s7;s7;s9;s5s10;s3s10;s2;s13;d14;s14;s16;s16;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H29NO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:9.65384
Area:437.569
Solvation:-1.28539
Coulombic:-22.938
Bond Count [?]
All:21
Single:20
Double:1
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:263.418
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.6
LogP (Chemaxon):3.87

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Experimental Annotations

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Descriptor Annotations

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