Chemical ID: 4756851

c1ccc(cc1)C(CN2CCCC2)O
Chemical ID:
4756851
Name [?]:
1-phenyl-2-pyrrolidin-1-yl-ethanol
SMILES [?]:
c1ccc(cc1)C(CN2CCCC2)O
InChi [?]:
InChI=1/C12H17NO/c14-12(10-13-8-4-5-9-13)11-6-2-1-3-7-11/h1-3,6-7,12,14H,4-5,8-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,11,12,3,5,10,13,8,4,7,9,14/E:(2,3)(4,5)(6,7)(8,9)/rA:14cCCCCCCCCNCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s9s12;s7;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:6.92596
Area:374.528
Solvation:-2.43724
Coulombic:-23.277
Bond Count [?]
All:15
Single:12
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:191.27
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.67
LogP (Chemaxon):1.89

Name Annotations

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Descriptor Annotations

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