Name: Name:3-Pyridinecarboxylic acid, 6-(1-piperazinyl)-, ethyl ester
Brand: Angene
SKU: AG0010SQ
Rating: 90 (10 reviews)

3-Pyridinecarboxylic acid, 6-(1-piperazinyl)-, ethyl ester

CAS No.:

132521-78-9

Catalog Number:

AG0010SQ

Molecular Formula:

C12H17N3O2

Molecular Weight:

235.2823

Catalog Number:

AG0010SQ

Chemical Name:

3-Pyridinecarboxylic acid, 6-(1-piperazinyl)-, ethyl ester

CAS Number:

132521-78-9

Molecular Formula:

C12H17N3O2

Molecular Weight:

235.2823

MDL Number:

MFCD00894968

IUPAC Name:

ethyl 6-piperazin-1-ylpyridine-3-carboxylate

InChI:

InChI=1S/C12H17N3O2/c1-2-17-12(16)10-3-4-11(14-9-10)15-7-5-13-6-8-15/h3-4,9,13H,2,5-8H2,1H3

InChI Key:

AMCQVTYZNLAJHD-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1ccc(nc1)N1CCNCC1

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.287g/mol

Monoisotopic Mass:

235.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9