Name: Name:1-[3-(aminomethyl)pyrrolidin-1-yl]-2-phenylethan-1-one
Brand: Angene
SKU: AG01A1HO
Rating: 90 (10 reviews)

1-[3-(aminomethyl)pyrrolidin-1-yl]-2-phenylethan-1-one

CAS No.:

1249004-11-2

Catalog Number:

AG01A1HO

Molecular Formula:

C13H18N2O

Molecular Weight:

218.2948

Catalog Number:

AG01A1HO

Chemical Name:

1-[3-(aminomethyl)pyrrolidin-1-yl]-2-phenylethan-1-one

CAS Number:

1249004-11-2

Molecular Formula:

C13H18N2O

Molecular Weight:

218.2948

MDL Number:

MFCD16675113

IUPAC Name:

1-[3-(aminomethyl)pyrrolidin-1-yl]-2-phenylethanone

InChI:

InChI=1S/C13H18N2O/c14-9-12-6-7-15(10-12)13(16)8-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2

InChI Key:

QODHPVUEPSNBEA-UHFFFAOYSA-N

SMILES:

NCC1CCN(C1)C(=O)Cc1ccccc1

Complexity:

236

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.3g/mol

Monoisotopic Mass:

218.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8