Home Other Building Blocks N,N-diethylpyrrolidine-2-carboxamide

N,N-diethylpyrrolidine-2-carboxamide

CAS No.:
1018331-52-6
Catalog Number:
AG01A7HJ
Molecular Formula:
C9H18N2O
Molecular Weight:
170.2520
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Product Description
Catalog Number:
AG01A7HJ
Chemical Name:
N,N-diethylpyrrolidine-2-carboxamide
CAS Number:
1018331-52-6
Molecular Formula:
C9H18N2O
Molecular Weight:
170.2520
MDL Number:
MFCD06357924
IUPAC Name:
N,N-diethylpyrrolidine-2-carboxamide
InChI:
InChI=1S/C9H18N2O/c1-3-11(4-2)9(12)8-6-5-7-10-8/h8,10H,3-7H2,1-2H3
InChI Key:
LVUPFABYBLEEMH-UHFFFAOYSA-N
SMILES:
CCN(C(=O)C1CCCN1)CC
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.142g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.256g/mol
Monoisotopic Mass:
170.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties