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799781-97-8 | 4H-PYRROLO[1,2-B]PYRAZOLE-2-CARBOXAMIDE, 5,6-DIHYDRO-N-METHOXY-N-METHYL-
CAS No: 799781-97-8 Catalog No: AG005EU3 MDL No:
Product Description
Catalog Number:
AG005EU3
Chemical Name:
4H-PYRROLO[1,2-B]PYRAZOLE-2-CARBOXAMIDE, 5,6-DIHYDRO-N-METHOXY-N-METHYL-
CAS Number:
799781-97-8
Molecular Formula:
C9H13N3O2
Molecular Weight:
195.2184
IUPAC Name:
N-methoxy-N-methyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
InChI:
InChI=1S/C9H13N3O2/c1-11(14-2)9(13)8-6-7-4-3-5-12(7)10-8/h6H,3-5H2,1-2H3
InChI Key:
FWHHOSCDELSADD-UHFFFAOYSA-N
SMILES:
CON(C(=O)c1nn2c(c1)CCC2)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.101g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.222g/mol
Monoisotopic Mass:
195.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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