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2-methyl-1-(5-methyl-1H-1,3-benzodiazol-2-yl)propan-1-amine

2-methyl-1-(5-methyl-1H-1,3-benzodiazol-2-yl)propan-1-amine

CAS: 7031-53-0

Formula: C12H17N3

SMILES: CC(C)C(N)C1=NC2=CC(C)=CC=C2N1

IUPAC: 2-methyl-1-(5-methyl-1H-1,3-benzodiazol-2-yl)propan-1-amine

InChI: InChI=1/C12H17N3/c1-7(2)11(13)12-14-9-5-4-8(3)6-10(9)15-12/h4-7,11H,13H2,1-3H3,(H,14,15)

Composition: C (70.90%), H (8.43%), N (20.67%)

Molar Mass: 203.289

Atom Count: 32

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 203.142247559
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey FYXUYWWJKLWESE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.3
Topological Polar Surface Area 54.7
Polarizability 25.37
Ring Count 2
Rotatable Bond Count 2

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