Name: Name:4-{[2-(pyridin-2-yl)ethyl]amino}benzoic acid
Brand: Angene
SKU: AG01BXH7
Rating: 90 (10 reviews)

4-{[2-(pyridin-2-yl)ethyl]amino}benzoic acid

CAS No.:

1273704-74-7

Catalog Number:

AG01BXH7

Molecular Formula:

C14H14N2O2

Molecular Weight:

242.2732

Catalog Number:

AG01BXH7

Chemical Name:

4-{[2-(pyridin-2-yl)ethyl]amino}benzoic acid

CAS Number:

1273704-74-7

Molecular Formula:

C14H14N2O2

Molecular Weight:

242.2732

MDL Number:

MFCD17417604

IUPAC Name:

4-(2-pyridin-2-ylethylamino)benzoic acid

InChI:

InChI=1S/C14H14N2O2/c17-14(18)11-4-6-13(7-5-11)16-10-8-12-3-1-2-9-15-12/h1-7,9,16H,8,10H2,(H,17,18)

InChI Key:

ZERPSBYNMZTSBZ-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)NCCc1ccccn1

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.278g/mol

Monoisotopic Mass:

242.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4