Chemical ID: 6685341

c1ccc(cc1)NCC2CCCN2
Chemical ID:
6685341
Name [?]:
N-(pyrrolidin-2-ylmethyl)aniline
SMILES [?]:
c1ccc(cc1)NCC2CCCN2
InChi [?]:
InChI=1/C11H16N2/c1-2-5-10(6-3-1)13-9-11-7-4-8-12-11/h1-3,5-6,11-13H,4,7-9H2
InChi Info:
AuxInfo=1/0/N:1,2,6,11,3,5,10,12,8,4,9,13,7/E:(2,3)(5,6)/rA:13cCCCCCCNCCCCCN/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H16N2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.57791
Area:361.763
Solvation:-1.46617
Coulombic:-21.4062
Bond Count [?]
All:14
Single:11
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:176.258
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.83
LogP (Chemaxon):1.63

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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