Chemical ID: 4732451

CC(C)(C1CC[N+](CC1)(C)C)O
Chemical ID:
4732451
Name [?]:
2-(1,1-dimethyl-3,4,5,6-tetrahydro-2H-pyridin-4-yl)propan-2-ol
SMILES [?]:
CC(C)(C1CC[N+](CC1)(C)C)O
InChi [?]:
InChI=1/C10H22NO/c1-10(2,12)9-5-7-11(3,4)8-6-9/h9,12H,5-8H2,1-4H3/q+1
InChi Info:
AuxInfo=1/0/N:1,3,10,11,5,9,6,8,4,2,7,12/E:(1,2)(3,4)(5,6)(7,8)/CRV:11+1/rA:12nCCCCCCN+CCCCO/rB:s1;s2;s2;s4;s5;s6;s7;s4s8;s7;s7;s2;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H22NO+
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:-20.7001
Area:331.164
Solvation:-28.9792
Coulombic:7.27395
Bond Count [?]
All:12
Single:12
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:172.288
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:-0.3
LogP (Chemaxon):-3.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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