2-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine

2-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine

CAS: 139962-68-8

Formula: C14H12N2O

SMILES: COC1=CC=C(C=C1)C1=CC2=CC=CN=C2N1

IUPAC: 2-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine

InChI: InChI=1S/C14H12N2O/c1-17-12-6-4-10(5-7-12)13-9-11-3-2-8-15-14(11)16-13/h2-9H,1H3,(H,15,16)

Composition: C (74.98%), H (5.39%), N (12.49%), O (7.13%)

Molar Mass: 224.263

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	224.094963014
Formal Charge	0
FSP3	0.07
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SHISXEDJQZVJAL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.42
Topological Polar Surface Area	37.91
Polarizability	27.52
Ring Count	3
Rotatable Bond Count	2

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