Chemical ID: 4913083

CC1C2Cc3ccc(cc3C1(CCN2C)C)O
Chemical ID:
4913083
Name [?]:
None
SMILES [?]:
CC1C2Cc3ccc(cc3C1(CCN2C)C)O
InChi [?]:
InChI=1/C15H21NO/c1-10-14-8-11-4-5-12(17)9-13(11)15(10,2)6-7-16(14)3/h4-5,9-10,14,17H,6-8H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,16,15,6,7,12,13,4,9,2,5,8,10,3,11,14,17/rA:17cCCCCCCCCCCCCCNCCO/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s2s10;s11;s12;s3s13;s14;s11;s8;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:4
ZAP Information [?]
Total:7.70011
Area:386.124
Solvation:-1.953
Coulombic:-22.0709
Bond Count [?]
All:19
Single:16
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:231.333
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.49
LogP (Chemaxon):2.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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