Name: Name:4-carbamoyl-3-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid
Brand: Angene
SKU: AG01A0CI
Rating: 90 (10 reviews)

4-carbamoyl-3-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid

CAS No.:

1423029-63-3

Catalog Number:

AG01A0CI

Molecular Formula:

C9H12N2O3

Molecular Weight:

196.2032

Catalog Number:

AG01A0CI

Chemical Name:

4-carbamoyl-3-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid

CAS Number:

1423029-63-3

Molecular Formula:

C9H12N2O3

Molecular Weight:

196.2032

MDL Number:

MFCD22565854

IUPAC Name:

4-carbamoyl-3-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid

InChI:

InChI=1S/C9H12N2O3/c1-3-5-6(8(10)12)4(2)11-7(5)9(13)14/h11H,3H2,1-2H3,(H2,10,12)(H,13,14)

InChI Key:

WVQHKUYRDYFEEG-UHFFFAOYSA-N

SMILES:

CCc1c(C(=O)N)c([nH]c1C(=O)O)C

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.206g/mol

Monoisotopic Mass:

196.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6