Chemical ID: 5788441

COC(=O)C1CCC(=C(C#N)C2=NC(CC2)C(=O)OC)N1
Chemical ID:
5788441
Name [?]:
methyl 5-[cyano-(5-methoxycarbonylpyrrolidin-2-ylidene)-methyl]-3,4-dihydro-2H-pyrrole-2-carboxylate
SMILES [?]:
COC(=O)C1CCC(=C(C#N)C2=NC(CC2)C(=O)OC)N1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H17N3O4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:2
ZAP Information [?]
Total:8.13901
Area:507.783
Solvation:-4.55557
Coulombic:-56.8163
Bond Count [?]
All:22
Single:17
Double:4
Rotors:5
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:291.303
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:-0.43
LogP (Chemaxon):-0.12

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Descriptor Annotations

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