Home Halogens 1-(6-chloropyrimidin-4-yl)pyrrolidine-2-carboxamide

1-(6-chloropyrimidin-4-yl)pyrrolidine-2-carboxamide

CAS No.:
1250424-99-7
Catalog Number:
AG01ABCT
Molecular Formula:
C9H11ClN4O
Molecular Weight:
226.6628
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Product Description
Catalog Number:
AG01ABCT
Chemical Name:
1-(6-chloropyrimidin-4-yl)pyrrolidine-2-carboxamide
CAS Number:
1250424-99-7
Molecular Formula:
C9H11ClN4O
Molecular Weight:
226.6628
MDL Number:
MFCD14611186
IUPAC Name:
1-(6-chloropyrimidin-4-yl)pyrrolidine-2-carboxamide
InChI:
InChI=1S/C9H11ClN4O/c10-7-4-8(13-5-12-7)14-3-1-2-6(14)9(11)15/h4-6H,1-3H2,(H2,11,15)
InChI Key:
ASJVRTCVLOIIOQ-UHFFFAOYSA-N
SMILES:
NC(=O)C1CCCN1c1ncnc(c1)Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.062g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.664g/mol
Monoisotopic Mass:
226.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties