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methyl 2-{1H-pyrrolo[2,3-b]pyridin-3-yl}acetate

methyl 2-{1H-pyrrolo[2,3-b]pyridin-3-yl}acetate

CAS: 169030-84-6

Formula: C10H10N2O2

SMILES: COC(=O)CC1=CNC2=NC=CC=C12

IUPAC: methyl 2-{1H-pyrrolo[2,3-b]pyridin-3-yl}acetate

InChI: InChI=1S/C10H10N2O2/c1-14-9(13)5-7-6-12-10-8(7)3-2-4-11-10/h2-4,6H,5H2,1H3,(H,11,12)

Composition: C (63.15%), H (5.30%), N (14.73%), O (16.82%)

Molar Mass: 190.202

Atom Count: 24

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 190.07422757
Formal Charge 0
FSP3 0.2
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BWLDWKHDOPUYAO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.02
Topological Polar Surface Area 54.98
Polarizability 20.26
Ring Count 2
Rotatable Bond Count 3

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