Home Carboxys 2-pyrrolidin-1-ylpyrimidine-4-carboxylic acid

2-pyrrolidin-1-ylpyrimidine-4-carboxylic acid

CAS No.:
933709-00-3
Catalog Number:
AG00J4ZO
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
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Product Description
Catalog Number:
AG00J4ZO
Chemical Name:
2-pyrrolidin-1-ylpyrimidine-4-carboxylic acid
CAS Number:
933709-00-3
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
IUPAC Name:
2-pyrrolidin-1-ylpyrimidine-4-carboxylic acid
InChI:
InChI=1S/C9H11N3O2/c13-8(14)7-3-4-10-9(11-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2,(H,13,14)
InChI Key:
ZSRCSGVWFNQPFQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc(n1)N1CCCC1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties