6-amino-5-methyl-1H-indole-2-carboxylic acid

6-amino-5-methyl-1H-indole-2-carboxylic acid

CAS: 1368088-59-8

Formula: C10H10N2O2

SMILES: CC1=C(N)C=C2NC(=CC2=C1)C(O)=O

IUPAC: 6-amino-5-methyl-1H-indole-2-carboxylic acid

InChI: InChI=1S/C10H10N2O2/c1-5-2-6-3-9(10(13)14)12-8(6)4-7(5)11/h2-4,12H,11H2,1H3,(H,13,14)

Composition: C (63.15%), H (5.30%), N (14.73%), O (16.82%)

Molar Mass: 190.202

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	190.07422757
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	QFVORHYFDQNXEG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.02
Topological Polar Surface Area	79.11
Polarizability	20.76
Ring Count	2
Rotatable Bond Count	1

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