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63591-79-7 | 2-methyl-4-(piperazine-1-carbonyl)quinoline
CAS No: 63591-79-7 Catalog No: AG01ADGT MDL No:MFCD09851660
Product Description
Catalog Number:
AG01ADGT
Chemical Name:
2-methyl-4-(piperazine-1-carbonyl)quinoline
CAS Number:
63591-79-7
Molecular Formula:
C15H17N3O
Molecular Weight:
255.3150
MDL Number:
MFCD09851660
IUPAC Name:
(2-methylquinolin-4-yl)-piperazin-1-ylmethanone
InChI:
InChI=1S/C15H17N3O/c1-11-10-13(12-4-2-3-5-14(12)17-11)15(19)18-8-6-16-7-9-18/h2-5,10,16H,6-9H2,1H3
InChI Key:
UCVGPJNXQYJZMA-UHFFFAOYSA-N
SMILES:
Cc1nc2ccccc2c(c1)C(=O)N1CCNCC1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.137g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.321g/mol
Monoisotopic Mass:
255.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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