({5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}methyl)dimethylamine

({5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}methyl)dimethylamine

CAS: 183208-54-0

Formula: C10H12BrN3

SMILES: CN(C)CC1=CNC2=NC=C(Br)C=C12

IUPAC: ({5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}methyl)dimethylamine

InChI: InChI=1S/C10H12BrN3/c1-14(2)6-7-4-12-10-9(7)3-8(11)5-13-10/h3-5H,6H2,1-2H3,(H,12,13)

Composition: C (47.26%), H (4.76%), Br (31.44%), N (16.54%)

Molar Mass: 254.131

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	253.02146
Formal Charge	0
FSP3	0.3
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HIPZAOGAROQWFZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.11
Topological Polar Surface Area	31.92
Polarizability	23.75
Ring Count	2
Rotatable Bond Count	2

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