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methyl 3-(piperidin-3-yl)-1H-indole-6-carboxylate

methyl 3-(piperidin-3-yl)-1H-indole-6-carboxylate

CAS: 1260766-36-6

Formula: C15H18N2O2

SMILES: COC(=O)C1=CC=C2C(NC=C2C2CCCNC2)=C1

IUPAC: methyl 3-(piperidin-3-yl)-1H-indole-6-carboxylate

InChI: InChI=1/C15H18N2O2/c1-19-15(18)10-4-5-12-13(9-17-14(12)7-10)11-3-2-6-16-8-11/h4-5,7,9,11,16-17H,2-3,6,8H2,1H3

Composition: C (69.74%), H (7.02%), N (10.84%), O (12.39%)

Molar Mass: 258.321

Atom Count: 37

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 258.136827828
Formal Charge 0
FSP3 0.4
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey XMUZOZYOLWQJSE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.51
Topological Polar Surface Area 54.12
Polarizability 29.89
Ring Count 3
Rotatable Bond Count 3

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