2-amino-N-(2-methylphenyl)-5-nitrobenzamide

2-amino-N-(2-methylphenyl)-5-nitrobenzamide

CAS: 23076-31-5

Formula: C14H13N3O3

SMILES: CC1=CC=CC=C1NC(=O)C1=CC(=CC=C1N)[N+]([O-])=O

IUPAC: 2-amino-N-(2-methylphenyl)-5-nitrobenzamide

InChI: InChI=1S/C14H13N3O3/c1-9-4-2-3-5-13(9)16-14(18)11-8-10(17(19)20)6-7-12(11)15/h2-8H,15H2,1H3,(H,16,18)

Composition: C (61.99%), H (4.83%), N (15.49%), O (17.69%)

Molar Mass: 271.276

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	271.095691291
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	ODOVIRSWBOYXDP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.65
Topological Polar Surface Area	98.26
Polarizability	27.72
Ring Count	2
Rotatable Bond Count	3

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