Chemical ID: 4557333

CN1CCCC1CN2CCCC2CO
Chemical ID:
4557333
Name [?]:
[1-[(1-methylpyrrolidin-2-yl)methyl]pyrrolidin-2-yl]methanol
SMILES [?]:
CN1CCCC1CN2CCCC2CO
InChi [?]:
InChI=1/C11H22N2O/c1-12-6-2-4-10(12)8-13-7-3-5-11(13)9-14/h10-11,14H,2-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,10,5,11,3,9,7,13,6,12,2,8,14/rA:14cCNCCCCCNCCCCCO/rB:s1;s2;s3;s4;s2s5;s6;s7;s8;s9;s10;s8s11;s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H22N2O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:4
ZAP Information [?]
Total:6.62225
Area:363.389
Solvation:-2.46248
Coulombic:-26.5562
Bond Count [?]
All:15
Single:15
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:198.305
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.29
LogP (Chemaxon):0.49

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Experimental Annotations

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Descriptor Annotations

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