1-(3-iodopyridin-2-yl)piperazine

1-(3-iodopyridin-2-yl)piperazine

CAS: 85386-98-7

Formula: C9H12IN3

SMILES: IC1=CC=CN=C1N1CCNCC1

IUPAC: 1-(3-iodopyridin-2-yl)piperazine

InChI: InChI=1S/C9H12IN3/c10-8-2-1-3-12-9(8)13-6-4-11-5-7-13/h1-3,11H,4-7H2

Composition: C (37.39%), H (4.18%), I (43.89%), N (14.53%)

Molar Mass: 289.12

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	289.00759
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YEMFQTAXPFSLAE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.76
Topological Polar Surface Area	28.16
Polarizability	23.88
Ring Count	2
Rotatable Bond Count	1

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