Chemical ID: 6653185

CCCCn1c(ccc1C)C
Chemical ID:
6653185
Name [?]:
1-butyl-2,5-dimethyl-pyrrole
SMILES [?]:
CCCCn1c(ccc1C)C
InChi [?]:
InChI=1/C10H17N/c1-4-5-8-11-9(2)6-7-10(11)3/h6-7H,4-5,8H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,10,11,2,3,8,7,4,9,6,5/E:(2,3)(6,7)(9,10)/rA:11nCCCCNCCCCCC/rB:s1;s2;s3;s4;s5;d6;s7;s5d8;s9;s6;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H17N
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:7.64962
Area:340.237
Solvation:-0.856299
Coulombic:-5.83291
Bond Count [?]
All:11
Single:9
Double:2
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:151.249
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.94
LogP (Chemaxon):2.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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