Name: Name:2-AMINO-1-BENZYL-4,5-DIMETHYL-1H-PYRROLE-3-CARBONITRILE
Brand: Angene
SKU: AG00D8TU
Rating: 90 (10 reviews)

2-AMINO-1-BENZYL-4,5-DIMETHYL-1H-PYRROLE-3-CARBONITRILE

CAS No.:

55817-72-6

Catalog Number:

AG00D8TU

Molecular Formula:

C14H15N3

Molecular Weight:

225.2890

Catalog Number:

AG00D8TU

Chemical Name:

2-AMINO-1-BENZYL-4,5-DIMETHYL-1H-PYRROLE-3-CARBONITRILE

CAS Number:

55817-72-6

Molecular Formula:

C14H15N3

Molecular Weight:

225.2890

MDL Number:

MFCD01935932

IUPAC Name:

2-amino-1-benzyl-4,5-dimethylpyrrole-3-carbonitrile

InChI:

InChI=1S/C14H15N3/c1-10-11(2)17(14(16)13(10)8-15)9-12-6-4-3-5-7-12/h3-7H,9,16H2,1-2H3

InChI Key:

RJDOFGRDZKVLTM-UHFFFAOYSA-N

SMILES:

N#Cc1c(N)n(c(c1C)C)Cc1ccccc1

Complexity:

300

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.295g/mol

Monoisotopic Mass:

225.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9