Chemical ID: 5155960

CC1(OC2COC(C2O1)c3cc([nH]n3)C(=O)N)C
Chemical ID:
5155960
Name [?]:
5-(7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0]oct-4-yl)-2H-pyrazole-3-carboxamide
SMILES [?]:
CC1(OC2COC(C2O1)c3cc([nH]n3)C(=O)N)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H15N3O4
All Atoms:18
Heavy Atoms:18
Chiral Atoms:3
ZAP Information [?]
Total:6.00453
Area:428.749
Solvation:-4.7142
Coulombic:-61.4496
Bond Count [?]
All:20
Single:17
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:253.255
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:-0.29
LogP (Chemaxon):-0.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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