4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine

4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine

CAS: 188343-77-3

Formula: C21H22FN3

SMILES: CN1CCC(CC1)C1=CC(=C(N1)C1=CC=C(F)C=C1)C1=CC=NC=C1

IUPAC: 4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine

InChI: InChI=1S/C21H22FN3/c1-25-12-8-16(9-13-25)20-14-19(15-6-10-23-11-7-15)21(24-20)17-2-4-18(22)5-3-17/h2-7,10-11,14,16,24H,8-9,12-13H2,1H3

Composition: C (75.20%), H (6.61%), F (5.66%), N (12.53%)

Molar Mass: 335.426

Atom Count: 47

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	335.179775883
Formal Charge	0
FSP3	0.29
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RBWNFHXBUDPAIO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.7
Topological Polar Surface Area	31.92
Polarizability	40.52
Ring Count	4
Rotatable Bond Count	3

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