Chemical ID: 7102920

CCCNCc1ccc(cc1)OC
Chemical ID:
7102920
Name [?]:
N-[(4-methoxyphenyl)methyl]propan-1-amine
SMILES [?]:
CCCNCc1ccc(cc1)OC
InChi [?]:
InChI=1/C11H17NO/c1-3-8-12-9-10-4-6-11(13-2)7-5-10/h4-7,12H,3,8-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,2,7,11,8,10,3,5,6,9,4,12/E:(4,5)(6,7)/rA:13nCCCNCCCCCCCOC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s9;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17NO
All Atoms:30
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.16624
Area:380.73
Solvation:-2.35202
Coulombic:-17.3855
Bond Count [?]
All:13
Single:10
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:179.259
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.23
LogP (Chemaxon):2.13

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Descriptor Annotations

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